From 0e1415b2e6495d568e43c48b5df6dd6d13376d4b Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Fri, 17 Jul 2026 22:51:47 +0800 Subject: [PATCH 1/9] update length_neutron values. As far as I can tell, the values in ITC Table 4.4.4.1 are the bound coherent scattering lengths in fm from: Neutron scattering lengths and cross sections Varley F. Sears Pages 26-37 | https://doi.org/10.1080/10448639208218770 Neutron News Volume 3, 1992 - Issue 3 --- templ_enum.cif | 166 ++++++++++++++++++++++++++++++++++++------------- 1 file changed, 124 insertions(+), 42 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index 1c9be3e..df2f273 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1156,48 +1156,130 @@ save_length_neutron loop_ _enumeration_defaults.index _enumeration_defaults.value - [ H ] -3.739 [ D ] 6.671 [ H1- ] -3.739 [ He ] 3.26 [ Li ] -1.90 - [ Li1+ ] -1.90 [ Be ] 7.79 [ Be2+ ] 7.79 [ B ] 5.30 [ C ] 6.646 - [ N ] 9.36 [ O ] 5.803 [ O1- ] 5.803 [ F ] 5.654 [ F1- ] 5.654 - [ Ne ] 4.547 [ Na ] 3.63 [ Na1+ ] 3.63 [ Mg ] 5.375 [ Mg2+ ] 5.375 - [ Al ] 3.449 [ Al3+ ] 3.449 [ Si ] 4.149 [ Si4+ ] 4.149 [ P ] 5.13 - [ S ] 2.847 [ Cl ] 9.577 [ Cl1- ] 9.577 [ Ar ] 1.909 [ K ] 3.71 - [ K1+ ] 3.71 [ Ca ] 4.90 [ Ca2+ ] 4.90 [ Sc ] 12.29 [ Sc3+ ] 12.29 - [ Ti ] -3.438 [ Ti2+ ] -3.438 [ Ti3+ ] -3.438 [ Ti4+ ] -3.438 [ V ] -0.3824 - [ V2+ ] -0.3824 [ V3+ ] -0.3824 [ V5+ ] -0.3824 [ Cr ] 3.635 [ Cr2+ ] 3.635 - [ Cr3+ ] 3.635 [ Mn ] -3.73 [ Mn2+ ] -3.73 [ Mn3+ ] -3.73 [ Mn4+ ] -3.73 - [ Fe ] 9.54 [ Fe2+ ] 9.54 [ Fe3+ ] 9.54 [ Co ] 2.50 [ Co2+ ] 2.50 - [ Co3+ ] 2.50 [ Ni ] 10.3 [ Ni2+ ] 10.3 [ Ni3+ ] 10.3 [ Cu ] 7.718 - [ Cu1+ ] 7.718 [ Cu2+ ] 7.718 [ Zn ] 5.689 [ Zn2+ ] 5.689 [ Ga ] 7.287 - [ Ga3+ ] 7.287 [ Ge ] 8.192 [ Ge4+ ] 8.192 [ As ] 6.58 [ Se ] 7.970 - [ Br ] 6.795 [ Br1- ] 6.795 [ Kr ] 7.80 [ Rb ] 7.08 [ Rb1+ ] 7.08 - [ Sr ] 7.02 [ Sr2+ ] 7.02 [ Y ] 7.75 [ Y3+ ] 7.75 [ Zr ] 7.16 - [ Zr4+ ] 7.16 [ Nb ] 7.054 [ Nb3+ ] 7.054 [ Nb5+ ] 7.054 [ Mo ] 6.95 - [ Mo3+ ] 6.95 [ Mo5+ ] 6.95 [ Mo6+ ] 6.95 [ Tc ] 6.8 [ Ru ] 7.21 - [ Ru3+ ] 7.21 [ Ru4+ ] 7.21 [ Rh ] 5.88 [ Rh3+ ] 5.88 [ Rh4+ ] 5.88 - [ Pd ] 5.91 [ Pd2+ ] 5.91 [ Pd4+ ] 5.91 [ Ag ] 5.922 [ Ag1+ ] 5.922 - [ Ag2+ ] 5.922 [ Cd ] 5.1 [ Cd2+ ] 5.1 [ In ] 4.065 [ In3+ ] 4.065 - [ Sn ] 6.225 [ Sn2+ ] 6.225 [ Sn4+ ] 6.225 [ Sb ] 5.57 [ Sb3+ ] 5.57 - [ Sb5+ ] 5.57 [ Te ] 5.80 [ I ] 5.28 [ I1- ] 5.28 [ Xe ] 4.85 - [ Cs ] 5.42 [ Cs1+ ] 5.42 [ Ba ] 5.06 [ Ba2+ ] 5.06 [ La ] 8.24 - [ La3+ ] 8.24 [ Ce ] 4.84 [ Ce3+ ] 4.84 [ Ce4+ ] 4.84 [ Pr ] 4.45 - [ Pr3+ ] 4.45 [ Pr4+ ] 4.45 [ Nd ] 7.69 [ Nd3+ ] 7.69 [ Pm ] 12.6 - [ Sm ] 4.2 [ Sm3+ ] 4.2 [ Eu ] 6.73 [ Eu2+ ] 6.73 [ Eu3+ ] 6.73 - [ Gd ] 9.5 [ Gd3+ ] 9.5 [ Tb ] 7.38 [ Tb3+ ] 7.38 [ Dy ] 16.9 - [ Dy3+ ] 16.9 [ Ho ] 8.08 [ Ho3+ ] 8.08 [ Er ] 8.03 [ Er3+ ] 8.03 - [ Tm ] 7.07 [ Tm3+ ] 7.07 [ Yb ] 12.41 [ Yb2+ ] 12.41 [ Yb3+ ] 12.41 - [ Lu ] 7.21 [ Lu3+ ] 7.21 [ Hf ] 7.77 [ Hf4+ ] 7.77 [ Ta ] 6.91 - [ Ta5+ ] 6.91 [ W ] 4.77 [ W6+ ] 4.77 [ Re ] 9.2 [ Os ] 11.0 - [ Os4+ ] 11.0 [ Ir ] 10.6 [ Ir3+ ] 10.6 [ Ir4+ ] 10.6 [ Pt ] 9.60 - [ Pt2+ ] 9.60 [ Pt4+ ] 9.60 [ Au ] 7.63 [ Au1+ ] 7.63 [ Au3+ ] 7.63 - [ Hg ] 12.692 [ Hg1+ ] 12.692 [ Hg2+ ] 12.692 [ Tl ] 8.776 [ Tl1+ ] 8.776 - [ Tl3+ ] 8.776 [ Pb ] 9.401 [ Pb2+ ] 9.401 [ Pb4+ ] 9.401 [ Bi ] 8.530 - [ Bi3+ ] 8.530 [ Bi5+ ] 8.530 [ Po ] 0. [ At ] 0. [ Rn ] 0. - [ Fr ] 0. [ Ra ] 10.0 [ Ra2+ ] 10.0 [ Ac ] 0. [ Ac3+ ] 0. - [ Th ] 10.63 [ Th4+ ] 10.63 [ Pa ] 9.1 [ U ] 8.417 [ U3+ ] 8.417 - [ U4+ ] 8.417 [ U6+ ] 8.417 [ Np ] 10.55 [ Np3+ ] 10.55 [ Np4+ ] 10.55 - [ Np6+ ] 10.55 [ Pu ] 14.1 [ Pu3+ ] 14.1 [ Pu4+ ] 14.1 [ Pu6+ ] 14.1 - [ Am ] 8.3 [ Cm ] 9.5 [ Bk ] 9.5 [ Cf ] 0. + [ H . ] -3.7390 [ H 1 ] -3.7406 [ H 2 ] 6.671 + [ D . ] 6.671 [ H 3 ] 4.792 [ He . ] 3.26 + [ He 3 ] 5.74-1.483i [ He 4 ] 3.26 [ Li . ] -1.90 + [ Li 6 ] 2.00-0.261i [ Li 7 ] -2.22 [ Be . ] 7.79 + [ B . ] 5.30-0.213i [ B 10 ] -0.1-1.066i [ B 11 ] 6.65 + [ C . ] 6.6460 [ C 12 ] 6.6511 [ C 13 ] 6.19 + [ N . ] 9.36 [ N 14 ] 9.37 [ N 15 ] 6.44 + [ O . ] 5.803 [ O 16 ] 5.803 [ O 17 ] 5.78 + [ O 18 ] 5.84 [ F . ] 5.654 [ Ne . ] 4.566 + [ Ne 20 ] 4.631 [ Ne 21 ] 6.66 [ Ne 22 ] 3.87 + [ Na . ] 3.63 [ Mg . ] 5.375 [ Mg 24 ] 5.66 + [ Mg 25 ] 3.62 [ Mg 26 ] 4.89 [ Al . ] 3.449 + [ Si . ] 4.1491 [ Si 28 ] 4.107 [ Si 29 ] 4.7 + [ Si 30 ] 4.58 [ P . ] 5.13 [ S . ] 2.847 + [ S 32 ] 2.804 [ S 33 ] 4.74 [ S 34 ] 3.48 + [ S 36 ] 3. [ Cl . ] 9.5770 [ Cl 35 ] 11.65 + [ Cl 37 ] 3.08 [ Ar . ] 1.909 [ Ar 36 ] 24.9 + [ Ar 38 ] 3.5 [ Ar 40 ] 1.83 [ K . ] 3.67 + [ K 39 ] 3.74 [ K 40 ] 3. [ K 41 ] 2.69 + [ Ca . ] 4.70 [ Ca 40 ] 4.80 [ Ca 42 ] 3.36 + [ Ca 43 ] -1.56 [ Ca 44 ] 1.42 [ Ca 46 ] 3.6 + [ Ca 48 ] 0.39 [ Sc . ] 12.29 [ Ti . ] -3.438 + [ Ti 46 ] 4.93 [ Ti 47 ] 3.63 [ Ti 48 ] -6.08 + [ Ti 49 ] 1.04 [ Ti 50 ] 6.18 [ V . ] -0.3824 + [ V 50 ] 7.6 [ V 51 ] -0.402 [ Cr . ] 3.635 + [ Cr 50 ] -4.5 [ Cr 52 ] 4.920 [ Cr 53 ] -4.20 + [ Cr 54 ] 4.55 [ Mn . ] -3.73 [ Fe . ] 9.45 + [ Fe 54 ] 4.2 [ Fe 56 ] 9.94 [ Fe 57 ] 2.3 + [ Fe 58 ] 15. [ Co . ] 2.49 [ Ni . ] 10.3 + [ Ni 58 ] 14.4 [ Ni 60 ] 2.8 [ Ni 61 ] 7.60 + [ Ni 62 ] -8.7 [ Ni 64 ] -0.37 [ Cu . ] 7.718 + [ Cu 63 ] 6.43 [ Cu 65 ] 10.61 [ Zn . ] 5.680 + [ Zn 64 ] 5.22 [ Zn 66 ] 5.97 [ Zn 67 ] 7.56 + [ Zn 68 ] 6.03 [ Zn 70 ] 6. [ Ga . ] 7.288 + [ Ga 69 ] 7.88 [ Ga 71 ] 6.40 [ Ge . ] 8.185 + [ Ge 70 ] 10 [ Ge 72 ] 8.51 [ Ge 73 ] 5.02 + [ Ge 74 ] 7.58 [ Ge 76 ] 8.2 [ As . ] 6.58 + [ Se . ] 7.970 [ Se 74 ] 0.8 [ Se 76 ] 12.2 + [ Se 77 ] 8.25 [ Se 78 ] 8.24 [ Se 80 ] 7.48 + [ Se 82 ] 6.34 [ Br . ] 6.795 [ Br 79 ] 6.8 + [ Br 81 ] 6.79 [ Kr . ] 7.81 [ Kr 78 ] ? + [ Kr 80 ] ? [ Kr 82 ] ? [ Kr 83 ] ? + [ Kr 84 ] ? [ Kr 86 ] 8.1 [ Rb . ] 7.09 + [ Rb 85 ] 7.03 [ Rb 87 ] 7.23 [ Sr . ] 7.02 + [ Sr 84 ] 7. [ Sr 86 ] 5.67 [ Sr 87 ] 7.40 + [ Sr 88 ] 7.15 [ Y . ] 7.75 [ Zr . ] 7.16 + [ Zr 90 ] 6.4 [ Zr 91 ] 8.7 [ Zr 92 ] 7.4 + [ Zr 94 ] 8.2 [ Zr 96 ] 5.5 [ Nb . ] 7.054 + [ Mo . ] 6.715 [ Mo 92 ] 6.91 [ Mo 94 ] 6.80 + [ Mo 95 ] 6.91 [ Mo 96 ] 6.20 [ Mo 97 ] 7.24 + [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] 6.8 + [ Ru . ] 7.03 [ Ru 96 ] ? [ Ru 98 ] ? + [ Ru 99 ] ? [ Ru 100 ] ? [ Ru 101 ] ? + [ Ru 102 ] ? [ Ru 104 ] ? [ Rh . ] 5.88 + [ Pd . ] 5.91 [ Pd 102 ] 7.7 [ Pd 104 ] 7.7 + [ Pd 105 ] 5.5 [ Pd 106 ] 6.4 [ Pd 108 ] 4.1 + [ Pd 110 ] 7.7 [ Ag . ] 5.922 [ Ag 107 ] 7.555 + [ Ag 109 ] 4.165 [ Cd . ] 4.87-0.70i [ Cd 106 ] 5. + [ Cd 108 ] 5.4 [ Cd 110 ] 5.9 [ Cd 111 ] 6.5 + [ Cd 112 ] 6.4 [ Cd 113 ] -8.0-5.73i [ Cd 114 ] 7.5 + [ Cd 116 ] 6.3 [ In . ] 4.065-0.0539i [ In 113 ] 5.39 + [ In 115 ] 4.01-0.0562i [ Sn . ] 6.225 [ Sn 112 ] 6. + [ Sn 114 ] 6.2 [ Sn 115 ] 6. [ Sn 116 ] 5.93 + [ Sn 117 ] 6.48 [ Sn 118 ] 6.07 [ Sn 119 ] 6.12 + [ Sn 120 ] 6.49 [ Sn 122 ] 5.74 [ Sn 124 ] 5.97 + [ Sb . ] 5.57 [ Sb 121 ] 5.71 [ Sb 123 ] 5.38 + [ Te . ] 5.80 [ Te 120 ] 5.3 [ Te 122 ] 3.8 + [ Te 123 ] -0.05-0.116i [ Te 124 ] 7.96 [ Te 125 ] 5.02 + [ Te 126 ] 5.56 [ Te 128 ] 5.89 [ Te 130 ] 6.02 + [ I . ] 5.28 [ Xe . ] 4.92 [ Xe 124 ] ? + [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? + [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? + [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42 + [ Ba . ] 5.07 [ Ba 130 ] -3.6 [ Ba 132 ] 7.8 + [ Ba 134 ] 5.7 [ Ba 135 ] 4.67 [ Ba 136 ] 4.91 + [ Ba 137 ] 6.83 [ Ba 138 ] 4.84 [ La . ] 8.24 + [ La 138 ] 8. [ La 139 ] 8.24 [ Ce . ] 4.84 + [ Ce 136 ] 5.80 [ Ce 138 ] 6.70 [ Ce 140 ] 4.84 + [ Ce 142 ] 4.75 [ Pr . ] 4.58 [ Nd . ] 7.69 + [ Nd 142 ] 7.7 [ Nd 143 ] 14. [ Nd 144 ] 2.8 + [ Nd 145 ] 14. [ Nd 146 ] 8.7 [ Nd 148 ] 5.7 + [ Nd 150 ] 5.3 [ Pm . ] 12.6 [ Sm . ] 0.80-1.65i + [ Sm 144 ] -3. [ Sm 147 ] 14. [ Sm 148 ] -3. + [ Sm 149 ] -19.2-11.7i [ Sm 150 ] 14. [ Sm 152 ] -5.00 + [ Sm 154 ] 9.3 [ Eu . ] 7.22-1.26i [ Eu 151 ] 6.13-2.53i + [ Eu 153 ] 8.22 [ Gd . ] 6.5-13.82i [ Gd 152 ] 10. + [ Gd 154 ] 10. [ Gd 155 ] 6.0-17.0i [ Gd 156 ] 6.3 + [ Gd 157 ] -1.14-71.9i [ Gd 158 ] 9. [ Gd 160 ] 9.15 + [ Tb . ] 7.38 [ Dy . ] 16.9-0.276i [ Dy 156 ] 6.1 + [ Dy 158 ] 6. [ Dy 160 ] 6.7 [ Dy 161 ] 10.3 + [ Dy 162 ] -1.4 [ Dy 163 ] 5.0 [ Dy 164 ] 49.4-0.79i + [ Ho . ] 8.01 [ Er . ] 7.79 [ Er 162 ] 8.8 + [ Er 164 ] 8.2 [ Er 166 ] 10.6 [ Er 167 ] 3.0 + [ Er 168 ] 7.4 [ Er 170 ] 9.6 [ Tm . ] 7.07 + [ Yb . ] 12.43 [ Yb 168 ] -4.07-0.62i [ Yb 170 ] 6.77 + [ Yb 171 ] 9.66 [ Yb 172 ] 9.43 [ Yb 173 ] 9.56 + [ Yb 174 ] 19.3 [ Yb 176 ] 8.72 [ Lu . ] 7.21 + [ Lu 175 ] 7.24 [ Lu 176 ] 6.1-0.57i [ Hf . ] 7.7 + [ Hf 174 ] 10.9 [ Hf 176 ] 6.61 [ Hf 177 ] 0.8 + [ Hf 178 ] 5.9 [ Hf 179 ] 7.46 [ Hf 180 ] 13.2 + [ Ta . ] 6.91 [ Ta 180 ] 7. [ Ta 181 ] 6.91 + [ W . ] 4.86 [ W 180 ] 5. [ W 182 ] 6.97 + [ W 183 ] 6.53 [ W 184 ] 7.48 [ W 186 ] -0.72 + [ Re . ] 9.2 [ Re 185 ] 9.0 [ Re 187 ] 9.3 + [ Os . ] 10.7 [ Os 184 ] 10. [ Os 186 ] 11.6 + [ Os 187 ] 10. [ Os 188 ] 7.6 [ Os 189 ] 10.7 + [ Os 190 ] 11.0 [ Os 192 ] 11.5 [ Ir . ] 10.6 + [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6 + [ Pt 190 ] 9.0 [ Pt 192 ] 9.9 [ Pt 194 ] 10.55 + [ Pt 195 ] 8.83 [ Pt 196 ] 9.89 [ Pt 198 ] 7.8 + [ Au . ] 7.63 [ Hg . ] 12.692 [ Hg 196 ] 30.3 + [ Hg 198 ] ? [ Hg 199 ] 16.9 [ Hg 200 ] ? + [ Hg 201 ] ? [ Hg 202 ] ? [ Hg 204 ] ? + [ Tl . ] 8.776 [ Tl 203 ] 6.99 [ Tl 205 ] 9.52 + [ Pb . ] 9.405 [ Pb 204 ] 9.90 [ Pb 206 ] 9.22 + [ Pb 207 ] 9.28 [ Pb 208 ] 9.50 [ Bi . ] 8.532 + [ Po . ] ? [ At . ] ? [ Rn . ] ? + [ Fr . ] ? [ Ra . ] 10.0 [ Ac . ] ? + [ Th . ] 10.31 [ Pa . ] 91 [ U . ] 8.417 + [ U 233 ] 10.1 [ U 234 ] 12.4 [ U 235 ] 10.47 + [ U 238 ] 8.402 [ Np . ] 10.55 [ Pu . ] ? + [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 + [ Pu 242 ] 8.1 [ Am . ] 8.3 [ Cm . ] ? + [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 [ Cm 248 ] 7.7 save_ From 4bd731e762f919d2d97cb9287638beb9bf0d0e5f Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 10:10:30 +0800 Subject: [PATCH 2/9] fix Tc values --- templ_enum.cif | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/templ_enum.cif b/templ_enum.cif index df2f273..14904a2 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1206,7 +1206,8 @@ save_length_neutron [ Zr 94 ] 8.2 [ Zr 96 ] 5.5 [ Nb . ] 7.054 [ Mo . ] 6.715 [ Mo 92 ] 6.91 [ Mo 94 ] 6.80 [ Mo 95 ] 6.91 [ Mo 96 ] 6.20 [ Mo 97 ] 7.24 - [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] 6.8 + [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] ? + [ Tc 97 ] ? [ Tc 98 ] ? [ Tc 99 ] 6.8 [ Ru . ] 7.03 [ Ru 96 ] ? [ Ru 98 ] ? [ Ru 99 ] ? [ Ru 100 ] ? [ Ru 101 ] ? [ Ru 102 ] ? [ Ru 104 ] ? [ Rh . ] 5.88 From 7a794101f059fba6bc25a6e2dc8d72acbf49963a Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 10:17:42 +0800 Subject: [PATCH 3/9] fix americium --- templ_enum.cif | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index 14904a2..d409496 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1279,8 +1279,9 @@ save_length_neutron [ U 233 ] 10.1 [ U 234 ] 12.4 [ U 235 ] 10.47 [ U 238 ] 8.402 [ Np . ] 10.55 [ Pu . ] ? [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 - [ Pu 242 ] 8.1 [ Am . ] 8.3 [ Cm . ] ? - [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 [ Cm 248 ] 7.7 + [ Pu 242 ] 8.1 [ Am . ] ? [ Am 243 ] 8.3 + [ Cm . ] ? [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 + [ Cm 248 ] 7.7 save_ From d8173d0522619a4193b71501e06a8a44a6c07c1a Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 11:25:42 +0800 Subject: [PATCH 4/9] Update values Every element should have a . entry. Monoisotopic elements have the same value repeated for their isotope. --- templ_enum.cif | 259 +++++++++++++++++++++++++------------------------ 1 file changed, 133 insertions(+), 126 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index d409496..7d924e0 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1156,132 +1156,139 @@ save_length_neutron loop_ _enumeration_defaults.index _enumeration_defaults.value - [ H . ] -3.7390 [ H 1 ] -3.7406 [ H 2 ] 6.671 - [ D . ] 6.671 [ H 3 ] 4.792 [ He . ] 3.26 - [ He 3 ] 5.74-1.483i [ He 4 ] 3.26 [ Li . ] -1.90 - [ Li 6 ] 2.00-0.261i [ Li 7 ] -2.22 [ Be . ] 7.79 - [ B . ] 5.30-0.213i [ B 10 ] -0.1-1.066i [ B 11 ] 6.65 - [ C . ] 6.6460 [ C 12 ] 6.6511 [ C 13 ] 6.19 - [ N . ] 9.36 [ N 14 ] 9.37 [ N 15 ] 6.44 - [ O . ] 5.803 [ O 16 ] 5.803 [ O 17 ] 5.78 - [ O 18 ] 5.84 [ F . ] 5.654 [ Ne . ] 4.566 - [ Ne 20 ] 4.631 [ Ne 21 ] 6.66 [ Ne 22 ] 3.87 - [ Na . ] 3.63 [ Mg . ] 5.375 [ Mg 24 ] 5.66 - [ Mg 25 ] 3.62 [ Mg 26 ] 4.89 [ Al . ] 3.449 - [ Si . ] 4.1491 [ Si 28 ] 4.107 [ Si 29 ] 4.7 - [ Si 30 ] 4.58 [ P . ] 5.13 [ S . ] 2.847 - [ S 32 ] 2.804 [ S 33 ] 4.74 [ S 34 ] 3.48 - [ S 36 ] 3. [ Cl . ] 9.5770 [ Cl 35 ] 11.65 - [ Cl 37 ] 3.08 [ Ar . ] 1.909 [ Ar 36 ] 24.9 - [ Ar 38 ] 3.5 [ Ar 40 ] 1.83 [ K . ] 3.67 - [ K 39 ] 3.74 [ K 40 ] 3. [ K 41 ] 2.69 - [ Ca . ] 4.70 [ Ca 40 ] 4.80 [ Ca 42 ] 3.36 - [ Ca 43 ] -1.56 [ Ca 44 ] 1.42 [ Ca 46 ] 3.6 - [ Ca 48 ] 0.39 [ Sc . ] 12.29 [ Ti . ] -3.438 - [ Ti 46 ] 4.93 [ Ti 47 ] 3.63 [ Ti 48 ] -6.08 - [ Ti 49 ] 1.04 [ Ti 50 ] 6.18 [ V . ] -0.3824 - [ V 50 ] 7.6 [ V 51 ] -0.402 [ Cr . ] 3.635 - [ Cr 50 ] -4.5 [ Cr 52 ] 4.920 [ Cr 53 ] -4.20 - [ Cr 54 ] 4.55 [ Mn . ] -3.73 [ Fe . ] 9.45 - [ Fe 54 ] 4.2 [ Fe 56 ] 9.94 [ Fe 57 ] 2.3 - [ Fe 58 ] 15. [ Co . ] 2.49 [ Ni . ] 10.3 - [ Ni 58 ] 14.4 [ Ni 60 ] 2.8 [ Ni 61 ] 7.60 - [ Ni 62 ] -8.7 [ Ni 64 ] -0.37 [ Cu . ] 7.718 - [ Cu 63 ] 6.43 [ Cu 65 ] 10.61 [ Zn . ] 5.680 - [ Zn 64 ] 5.22 [ Zn 66 ] 5.97 [ Zn 67 ] 7.56 - [ Zn 68 ] 6.03 [ Zn 70 ] 6. [ Ga . ] 7.288 - [ Ga 69 ] 7.88 [ Ga 71 ] 6.40 [ Ge . ] 8.185 - [ Ge 70 ] 10 [ Ge 72 ] 8.51 [ Ge 73 ] 5.02 - [ Ge 74 ] 7.58 [ Ge 76 ] 8.2 [ As . ] 6.58 - [ Se . ] 7.970 [ Se 74 ] 0.8 [ Se 76 ] 12.2 - [ Se 77 ] 8.25 [ Se 78 ] 8.24 [ Se 80 ] 7.48 - [ Se 82 ] 6.34 [ Br . ] 6.795 [ Br 79 ] 6.8 - [ Br 81 ] 6.79 [ Kr . ] 7.81 [ Kr 78 ] ? - [ Kr 80 ] ? [ Kr 82 ] ? [ Kr 83 ] ? - [ Kr 84 ] ? [ Kr 86 ] 8.1 [ Rb . ] 7.09 - [ Rb 85 ] 7.03 [ Rb 87 ] 7.23 [ Sr . ] 7.02 - [ Sr 84 ] 7. [ Sr 86 ] 5.67 [ Sr 87 ] 7.40 - [ Sr 88 ] 7.15 [ Y . ] 7.75 [ Zr . ] 7.16 - [ Zr 90 ] 6.4 [ Zr 91 ] 8.7 [ Zr 92 ] 7.4 - [ Zr 94 ] 8.2 [ Zr 96 ] 5.5 [ Nb . ] 7.054 - [ Mo . ] 6.715 [ Mo 92 ] 6.91 [ Mo 94 ] 6.80 - [ Mo 95 ] 6.91 [ Mo 96 ] 6.20 [ Mo 97 ] 7.24 - [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] ? - [ Tc 97 ] ? [ Tc 98 ] ? [ Tc 99 ] 6.8 - [ Ru . ] 7.03 [ Ru 96 ] ? [ Ru 98 ] ? - [ Ru 99 ] ? [ Ru 100 ] ? [ Ru 101 ] ? - [ Ru 102 ] ? [ Ru 104 ] ? [ Rh . ] 5.88 - [ Pd . ] 5.91 [ Pd 102 ] 7.7 [ Pd 104 ] 7.7 - [ Pd 105 ] 5.5 [ Pd 106 ] 6.4 [ Pd 108 ] 4.1 - [ Pd 110 ] 7.7 [ Ag . ] 5.922 [ Ag 107 ] 7.555 - [ Ag 109 ] 4.165 [ Cd . ] 4.87-0.70i [ Cd 106 ] 5. - [ Cd 108 ] 5.4 [ Cd 110 ] 5.9 [ Cd 111 ] 6.5 - [ Cd 112 ] 6.4 [ Cd 113 ] -8.0-5.73i [ Cd 114 ] 7.5 - [ Cd 116 ] 6.3 [ In . ] 4.065-0.0539i [ In 113 ] 5.39 - [ In 115 ] 4.01-0.0562i [ Sn . ] 6.225 [ Sn 112 ] 6. - [ Sn 114 ] 6.2 [ Sn 115 ] 6. [ Sn 116 ] 5.93 - [ Sn 117 ] 6.48 [ Sn 118 ] 6.07 [ Sn 119 ] 6.12 - [ Sn 120 ] 6.49 [ Sn 122 ] 5.74 [ Sn 124 ] 5.97 - [ Sb . ] 5.57 [ Sb 121 ] 5.71 [ Sb 123 ] 5.38 - [ Te . ] 5.80 [ Te 120 ] 5.3 [ Te 122 ] 3.8 - [ Te 123 ] -0.05-0.116i [ Te 124 ] 7.96 [ Te 125 ] 5.02 - [ Te 126 ] 5.56 [ Te 128 ] 5.89 [ Te 130 ] 6.02 - [ I . ] 5.28 [ Xe . ] 4.92 [ Xe 124 ] ? - [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? - [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? - [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42 - [ Ba . ] 5.07 [ Ba 130 ] -3.6 [ Ba 132 ] 7.8 - [ Ba 134 ] 5.7 [ Ba 135 ] 4.67 [ Ba 136 ] 4.91 - [ Ba 137 ] 6.83 [ Ba 138 ] 4.84 [ La . ] 8.24 - [ La 138 ] 8. [ La 139 ] 8.24 [ Ce . ] 4.84 - [ Ce 136 ] 5.80 [ Ce 138 ] 6.70 [ Ce 140 ] 4.84 - [ Ce 142 ] 4.75 [ Pr . ] 4.58 [ Nd . ] 7.69 - [ Nd 142 ] 7.7 [ Nd 143 ] 14. [ Nd 144 ] 2.8 - [ Nd 145 ] 14. [ Nd 146 ] 8.7 [ Nd 148 ] 5.7 - [ Nd 150 ] 5.3 [ Pm . ] 12.6 [ Sm . ] 0.80-1.65i - [ Sm 144 ] -3. [ Sm 147 ] 14. [ Sm 148 ] -3. - [ Sm 149 ] -19.2-11.7i [ Sm 150 ] 14. [ Sm 152 ] -5.00 - [ Sm 154 ] 9.3 [ Eu . ] 7.22-1.26i [ Eu 151 ] 6.13-2.53i - [ Eu 153 ] 8.22 [ Gd . ] 6.5-13.82i [ Gd 152 ] 10. - [ Gd 154 ] 10. [ Gd 155 ] 6.0-17.0i [ Gd 156 ] 6.3 - [ Gd 157 ] -1.14-71.9i [ Gd 158 ] 9. [ Gd 160 ] 9.15 - [ Tb . ] 7.38 [ Dy . ] 16.9-0.276i [ Dy 156 ] 6.1 - [ Dy 158 ] 6. [ Dy 160 ] 6.7 [ Dy 161 ] 10.3 - [ Dy 162 ] -1.4 [ Dy 163 ] 5.0 [ Dy 164 ] 49.4-0.79i - [ Ho . ] 8.01 [ Er . ] 7.79 [ Er 162 ] 8.8 - [ Er 164 ] 8.2 [ Er 166 ] 10.6 [ Er 167 ] 3.0 - [ Er 168 ] 7.4 [ Er 170 ] 9.6 [ Tm . ] 7.07 - [ Yb . ] 12.43 [ Yb 168 ] -4.07-0.62i [ Yb 170 ] 6.77 - [ Yb 171 ] 9.66 [ Yb 172 ] 9.43 [ Yb 173 ] 9.56 - [ Yb 174 ] 19.3 [ Yb 176 ] 8.72 [ Lu . ] 7.21 - [ Lu 175 ] 7.24 [ Lu 176 ] 6.1-0.57i [ Hf . ] 7.7 - [ Hf 174 ] 10.9 [ Hf 176 ] 6.61 [ Hf 177 ] 0.8 - [ Hf 178 ] 5.9 [ Hf 179 ] 7.46 [ Hf 180 ] 13.2 - [ Ta . ] 6.91 [ Ta 180 ] 7. [ Ta 181 ] 6.91 - [ W . ] 4.86 [ W 180 ] 5. [ W 182 ] 6.97 - [ W 183 ] 6.53 [ W 184 ] 7.48 [ W 186 ] -0.72 - [ Re . ] 9.2 [ Re 185 ] 9.0 [ Re 187 ] 9.3 - [ Os . ] 10.7 [ Os 184 ] 10. [ Os 186 ] 11.6 - [ Os 187 ] 10. [ Os 188 ] 7.6 [ Os 189 ] 10.7 - [ Os 190 ] 11.0 [ Os 192 ] 11.5 [ Ir . ] 10.6 - [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6 - [ Pt 190 ] 9.0 [ Pt 192 ] 9.9 [ Pt 194 ] 10.55 - [ Pt 195 ] 8.83 [ Pt 196 ] 9.89 [ Pt 198 ] 7.8 - [ Au . ] 7.63 [ Hg . ] 12.692 [ Hg 196 ] 30.3 - [ Hg 198 ] ? [ Hg 199 ] 16.9 [ Hg 200 ] ? - [ Hg 201 ] ? [ Hg 202 ] ? [ Hg 204 ] ? - [ Tl . ] 8.776 [ Tl 203 ] 6.99 [ Tl 205 ] 9.52 - [ Pb . ] 9.405 [ Pb 204 ] 9.90 [ Pb 206 ] 9.22 - [ Pb 207 ] 9.28 [ Pb 208 ] 9.50 [ Bi . ] 8.532 - [ Po . ] ? [ At . ] ? [ Rn . ] ? - [ Fr . ] ? [ Ra . ] 10.0 [ Ac . ] ? - [ Th . ] 10.31 [ Pa . ] 91 [ U . ] 8.417 - [ U 233 ] 10.1 [ U 234 ] 12.4 [ U 235 ] 10.47 - [ U 238 ] 8.402 [ Np . ] 10.55 [ Pu . ] ? - [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 - [ Pu 242 ] 8.1 [ Am . ] ? [ Am 243 ] 8.3 - [ Cm . ] ? [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 - [ Cm 248 ] 7.7 + [ H . ] -3.7390 [ H 1 ] -3.7406 [ H 2 ] 6.671 + [ D . ] 6.671 [ D 2 ] 6.671 [ H 3 ] 4.792 + [ He . ] 3.26 [ He 3 ] 5.74-1.483i [ He 4 ] 3.26 + [ Li . ] -1.90 [ Li 6 ] 2.00-0.261i [ Li 7 ] -2.22 + [ Be . ] 7.79 [ Be 9 ] 7.79 [ B . ] 5.30-0.213i + [ B 10 ] -0.1-1.066i [ B 11 ] 6.65 [ C . ] 6.6460 + [ C 12 ] 6.6511 [ C 13 ] 6.19 [ N . ] 9.36 + [ N 14 ] 9.37 [ N 15 ] 6.44 [ O . ] 5.803 + [ O 16 ] 5.803 [ O 17 ] 5.78 [ O 18 ] 5.84 + [ F . ] 5.654 [ F 19 ] 5.654 [ Ne . ] 4.566 + [ Ne 20 ] 4.631 [ Ne 21 ] 6.66 [ Ne 22 ] 3.87 + [ Na . ] 3.63 [ Na 23 ] 3.63 [ Mg . ] 5.375 + [ Mg 24 ] 5.66 [ Mg 25 ] 3.62 [ Mg 26 ] 4.89 + [ Al . ] 3.449 [ Al 27 ] 3.449 [ Si . ] 4.1491 + [ Si 28 ] 4.107 [ Si 29 ] 4.7 [ Si 30 ] 4.58 + [ P . ] 5.13 [ P 31 ] 5.13 [ S . ] 2.847 + [ S 32 ] 2.804 [ S 33 ] 4.74 [ S 34 ] 3.48 + [ S 36 ] 3. [ Cl . ] 9.5770 [ Cl 35 ] 11.65 + [ Cl 37 ] 3.08 [ Ar . ] 1.909 [ Ar 36 ] 24.9 + [ Ar 38 ] 3.5 [ Ar 40 ] 1.83 [ K . ] 3.67 + [ K 39 ] 3.74 [ K 40 ] 3. [ K 41 ] 2.69 + [ Ca . ] 4.70 [ Ca 40 ] 4.80 [ Ca 42 ] 3.36 + [ Ca 43 ] -1.56 [ Ca 44 ] 1.42 [ Ca 46 ] 3.6 + [ Ca 48 ] 0.39 [ Sc . ] 12.29 [ Sc 45 ] 12.29 + [ Ti . ] -3.438 [ Ti 46 ] 4.93 [ Ti 47 ] 3.63 + [ Ti 48 ] -6.08 [ Ti 49 ] 1.04 [ Ti 50 ] 6.18 + [ V . ] -0.3824 [ V 50 ] 7.6 [ V 51 ] -0.402 + [ Cr . ] 3.635 [ Cr 50 ] -4.5 [ Cr 52 ] 4.920 + [ Cr 53 ] -4.20 [ Cr 54 ] 4.55 [ Mn . ] -3.73 + [ Mn 55 ] -3.73 [ Fe . ] 9.45 [ Fe 54 ] 4.2 + [ Fe 56 ] 9.94 [ Fe 57 ] 2.3 [ Fe 58 ] 15. + [ Co . ] 2.49 [ Co 59 ] 2.49 [ Ni . ] 10.3 + [ Ni 58 ] 14.4 [ Ni 60 ] 2.8 [ Ni 61 ] 7.60 + [ Ni 62 ] -8.7 [ Ni 64 ] -0.37 [ Cu . ] 7.718 + [ Cu 63 ] 6.43 [ Cu 65 ] 10.61 [ Zn . ] 5.680 + [ Zn 64 ] 5.22 [ Zn 66 ] 5.97 [ Zn 67 ] 7.56 + [ Zn 68 ] 6.03 [ Zn 70 ] 6. [ Ga . ] 7.288 + [ Ga 69 ] 7.88 [ Ga 71 ] 6.40 [ Ge . ] 8.185 + [ Ge 70 ] 10.0 [ Ge 72 ] 8.51 [ Ge 73 ] 5.02 + [ Ge 74 ] 7.58 [ Ge 76 ] 8.2 [ As . ] 6.58 + [ As 75 ] 6.58 [ Se . ] 7.970 [ Se 74 ] 0.8 + [ Se 76 ] 12.2 [ Se 77 ] 8.25 [ Se 78 ] 8.24 + [ Se 80 ] 7.48 [ Se 82 ] 6.34 [ Br . ] 6.795 + [ Br 79 ] 6.8 [ Br 81 ] 6.79 [ Kr . ] 7.81 + [ Kr 78 ] ? [ Kr 80 ] ? [ Kr 82 ] ? + [ Kr 83 ] ? [ Kr 84 ] ? [ Kr 86 ] 8.1 + [ Rb . ] 7.09 [ Rb 85 ] 7.03 [ Rb 87 ] 7.23 + [ Sr . ] 7.02 [ Sr 84 ] 7. [ Sr 86 ] 5.67 + [ Sr 87 ] 7.40 [ Sr 88 ] 7.15 [ Y . ] 7.75 + [ Y 89 ] 7.75 [ Zr . ] 7.16 [ Zr 90 ] 6.4 + [ Zr 91 ] 8.7 [ Zr 92 ] 7.4 [ Zr 94 ] 8.2 + [ Zr 96 ] 5.5 [ Nb . ] 7.054 [ Nb 93 ] 7.054 + [ Mo . ] 6.715 [ Mo 92 ] 6.91 [ Mo 94 ] 6.80 + [ Mo 95 ] 6.91 [ Mo 96 ] 6.20 [ Mo 97 ] 7.24 + [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] ? + [ Tc 99 ] 6.8 [ Ru . ] 7.03 [ Ru 96 ] ? + [ Ru 98 ] ? [ Ru 99 ] ? [ Ru 100 ] ? + [ Ru 101 ] ? [ Ru 102 ] ? [ Ru 104 ] ? + [ Rh . ] 5.88 [ Rh 103 ] 5.88 [ Pd . ] 5.91 + [ Pd 102 ] 7.7 [ Pd 104 ] 7.7 [ Pd 105 ] 5.5 + [ Pd 106 ] 6.4 [ Pd 108 ] 4.1 [ Pd 110 ] 7.7 + [ Ag . ] 5.922 [ Ag 107 ] 7.555 [ Ag 109 ] 4.165 + [ Cd . ] 4.87-0.70i [ Cd 106 ] 5. [ Cd 108 ] 5.4 + [ Cd 110 ] 5.9 [ Cd 111 ] 6.5 [ Cd 112 ] 6.4 + [ Cd 113 ] -8.0-5.73i [ Cd 114 ] 7.5 [ Cd 116 ] 6.3 + [ In . ] 4.065-0.0539i [ In 113 ] 5.39 [ In 115 ] 4.01-0.0562i + [ Sn . ] 6.225 [ Sn 112 ] 6. [ Sn 114 ] 6.2 + [ Sn 115 ] 6. [ Sn 116 ] 5.93 [ Sn 117 ] 6.48 + [ Sn 118 ] 6.07 [ Sn 119 ] 6.12 [ Sn 120 ] 6.49 + [ Sn 122 ] 5.74 [ Sn 124 ] 5.97 [ Sb . ] 5.57 + [ Sb 121 ] 5.71 [ Sb 123 ] 5.38 [ Te . ] 5.80 + [ Te 120 ] 5.3 [ Te 122 ] 3.8 [ Te 123 ] -0.05-0.116i + [ Te 124 ] 7.96 [ Te 125 ] 5.02 [ Te 126 ] 5.56 + [ Te 128 ] 5.89 [ Te 130 ] 6.02 [ I . ] 5.28 + [ I 127 ] 5.28 [ Xe . ] 4.92 [ Xe 124 ] ? + [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? + [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? + [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42 + [ Cs 133 ] 5.42 [ Ba . ] 5.07 [ Ba 130 ] -3.6 + [ Ba 132 ] 7.8 [ Ba 134 ] 5.7 [ Ba 135 ] 4.67 + [ Ba 136 ] 4.91 [ Ba 137 ] 6.83 [ Ba 138 ] 4.84 + [ La . ] 8.24 [ La 138 ] 8. [ La 139 ] 8.24 + [ Ce . ] 4.84 [ Ce 136 ] 5.80 [ Ce 138 ] 6.70 + [ Ce 140 ] 4.84 [ Ce 142 ] 4.75 [ Pr . ] 4.58 + [ Pr 141 ] 4.58 [ Nd . ] 7.69 [ Nd 142 ] 7.7 + [ Nd 143 ] 14. [ Nd 144 ] 2.8 [ Nd 145 ] 14. + [ Nd 146 ] 8.7 [ Nd 148 ] 5.7 [ Nd 150 ] 5.3 + [ Pm . ] ? [ Pm 147 ] 12.6 [ Sm . ] 0.80-1.65i + [ Sm 144 ] -3. [ Sm 147 ] 14. [ Sm 148 ] -3. + [ Sm 149 ] -19.2-11.7i [ Sm 150 ] 14. [ Sm 152 ] -5.00 + [ Sm 154 ] 9.3 [ Eu . ] 7.22-1.26i [ Eu 151 ] 6.13-2.53i + [ Eu 153 ] 8.22 [ Gd . ] 6.5-13.82i [ Gd 152 ] 10. + [ Gd 154 ] 10. [ Gd 155 ] 6.0-17.0i [ Gd 156 ] 6.3 + [ Gd 157 ] -1.14-71.9i [ Gd 158 ] 9. [ Gd 160 ] 9.15 + [ Tb . ] 7.38 [ Tb 159 ] 7.38 [ Dy . ] 16.9-0.276i + [ Dy 156 ] 6.1 [ Dy 158 ] 6. [ Dy 160 ] 6.7 + [ Dy 161 ] 10.3 [ Dy 162 ] -1.4 [ Dy 163 ] 5.0 + [ Dy 164 ] 49.4-0.79i [ Ho . ] 8.01 [ Ho 165 ] 8.01 + [ Er . ] 7.79 [ Er 162 ] 8.8 [ Er 164 ] 8.2 + [ Er 166 ] 10.6 [ Er 167 ] 3.0 [ Er 168 ] 7.4 + [ Er 170 ] 9.6 [ Tm . ] 7.07 [ Tm 169 ] 7.07 + [ Yb . ] 12.43 [ Yb 168 ] -4.07-0.62i [ Yb 170 ] 6.77 + [ Yb 171 ] 9.66 [ Yb 172 ] 9.43 [ Yb 173 ] 9.56 + [ Yb 174 ] 19.3 [ Yb 176 ] 8.72 [ Lu . ] 7.21 + [ Lu 175 ] 7.24 [ Lu 176 ] 6.1-0.57i [ Hf . ] 7.7 + [ Hf 174 ] 10.9 [ Hf 176 ] 6.61 [ Hf 177 ] 0.8 + [ Hf 178 ] 5.9 [ Hf 179 ] 7.46 [ Hf 180 ] 13.2 + [ Ta . ] 6.91 [ Ta 180 ] 7. [ Ta 181 ] 6.91 + [ W . ] 4.86 [ W 180 ] 5. [ W 182 ] 6.97 + [ W 183 ] 6.53 [ W 184 ] 7.48 [ W 186 ] -0.72 + [ Re . ] 9.2 [ Re 185 ] 9.0 [ Re 187 ] 9.3 + [ Os . ] 10.7 [ Os 184 ] 10. [ Os 186 ] 11.6 + [ Os 187 ] 10. [ Os 188 ] 7.6 [ Os 189 ] 10.7 + [ Os 190 ] 11.0 [ Os 192 ] 11.5 [ Ir . ] 10.6 + [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6 + [ Pt 190 ] 9.0 [ Pt 192 ] 9.9 [ Pt 194 ] 10.55 + [ Pt 195 ] 8.83 [ Pt 196 ] 9.89 [ Pt 198 ] 7.8 + [ Au . ] 7.63 [ Au 197 ] 7.63 [ Hg . ] 12.692 + [ Hg 196 ] 30.3 [ Hg 198 ] ? [ Hg 199 ] 16.9 + [ Hg 200 ] ? [ Hg 201 ] ? [ Hg 202 ] ? + [ Hg 204 ] ? [ Tl . ] 8.776 [ Tl 203 ] 6.99 + [ Tl 205 ] 9.52 [ Pb . ] 9.405 [ Pb 204 ] 9.90 + [ Pb 206 ] 9.22 [ Pb 207 ] 9.28 [ Pb 208 ] 9.50 + [ Bi . ] 8.532 [ Bi 209 ] 8.532 [ Po . ] ? + [ At . ] ? [ Rn . ] ? [ Fr . ] ? + [ Ra . ] ? [ Ra 226 ] 10.0 [ Ac . ] ? + [ Th . ] ? [ Th 232 ] 10.31 [ Pa . ] 9.1 + [ Pa 231 ] 9.1 [ U . ] 8.417 [ U 233 ] 10.1 + [ U 234 ] 12.4 [ U 235 ] 10.47 [ U 238 ] 8.402 + [ Np . ] ? [ Np 237 ] 10.55 [ Pu . ] ? + [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 + [ Pu 242 ] 8.1 [ Am 243 ] 8.3 [ Cm . ] ? + [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 [ Cm 248 ] 7.7 save_ From da30393f2602c7d4c2b19b0459cc12ae27c8030b Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 11:46:25 +0800 Subject: [PATCH 5/9] added missing Am . --- templ_enum.cif | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index 7d924e0..e2b8383 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1287,8 +1287,9 @@ save_length_neutron [ U 234 ] 12.4 [ U 235 ] 10.47 [ U 238 ] 8.402 [ Np . ] ? [ Np 237 ] 10.55 [ Pu . ] ? [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 - [ Pu 242 ] 8.1 [ Am 243 ] 8.3 [ Cm . ] ? - [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 [ Cm 248 ] 7.7 + [ Pu 242 ] 8.1 [ Am . ] ? [ Am 243 ] 8.3 + [ Cm . ] ? [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 + [ Cm 248 ] 7.7 save_ From 2274fc4f3345ddbed5d23afa349c02bbdeca692b Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 12:01:59 +0800 Subject: [PATCH 6/9] added su values as given in the paper. Feel free to revert this commit. --- templ_enum.cif | 268 ++++++++++++++++++++++++------------------------- 1 file changed, 134 insertions(+), 134 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index e2b8383..d6062f1 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1156,140 +1156,140 @@ save_length_neutron loop_ _enumeration_defaults.index _enumeration_defaults.value - [ H . ] -3.7390 [ H 1 ] -3.7406 [ H 2 ] 6.671 - [ D . ] 6.671 [ D 2 ] 6.671 [ H 3 ] 4.792 - [ He . ] 3.26 [ He 3 ] 5.74-1.483i [ He 4 ] 3.26 - [ Li . ] -1.90 [ Li 6 ] 2.00-0.261i [ Li 7 ] -2.22 - [ Be . ] 7.79 [ Be 9 ] 7.79 [ B . ] 5.30-0.213i - [ B 10 ] -0.1-1.066i [ B 11 ] 6.65 [ C . ] 6.6460 - [ C 12 ] 6.6511 [ C 13 ] 6.19 [ N . ] 9.36 - [ N 14 ] 9.37 [ N 15 ] 6.44 [ O . ] 5.803 - [ O 16 ] 5.803 [ O 17 ] 5.78 [ O 18 ] 5.84 - [ F . ] 5.654 [ F 19 ] 5.654 [ Ne . ] 4.566 - [ Ne 20 ] 4.631 [ Ne 21 ] 6.66 [ Ne 22 ] 3.87 - [ Na . ] 3.63 [ Na 23 ] 3.63 [ Mg . ] 5.375 - [ Mg 24 ] 5.66 [ Mg 25 ] 3.62 [ Mg 26 ] 4.89 - [ Al . ] 3.449 [ Al 27 ] 3.449 [ Si . ] 4.1491 - [ Si 28 ] 4.107 [ Si 29 ] 4.7 [ Si 30 ] 4.58 - [ P . ] 5.13 [ P 31 ] 5.13 [ S . ] 2.847 - [ S 32 ] 2.804 [ S 33 ] 4.74 [ S 34 ] 3.48 - [ S 36 ] 3. [ Cl . ] 9.5770 [ Cl 35 ] 11.65 - [ Cl 37 ] 3.08 [ Ar . ] 1.909 [ Ar 36 ] 24.9 - [ Ar 38 ] 3.5 [ Ar 40 ] 1.83 [ K . ] 3.67 - [ K 39 ] 3.74 [ K 40 ] 3. [ K 41 ] 2.69 - [ Ca . ] 4.70 [ Ca 40 ] 4.80 [ Ca 42 ] 3.36 - [ Ca 43 ] -1.56 [ Ca 44 ] 1.42 [ Ca 46 ] 3.6 - [ Ca 48 ] 0.39 [ Sc . ] 12.29 [ Sc 45 ] 12.29 - [ Ti . ] -3.438 [ Ti 46 ] 4.93 [ Ti 47 ] 3.63 - [ Ti 48 ] -6.08 [ Ti 49 ] 1.04 [ Ti 50 ] 6.18 - [ V . ] -0.3824 [ V 50 ] 7.6 [ V 51 ] -0.402 - [ Cr . ] 3.635 [ Cr 50 ] -4.5 [ Cr 52 ] 4.920 - [ Cr 53 ] -4.20 [ Cr 54 ] 4.55 [ Mn . ] -3.73 - [ Mn 55 ] -3.73 [ Fe . ] 9.45 [ Fe 54 ] 4.2 - [ Fe 56 ] 9.94 [ Fe 57 ] 2.3 [ Fe 58 ] 15. - [ Co . ] 2.49 [ Co 59 ] 2.49 [ Ni . ] 10.3 - [ Ni 58 ] 14.4 [ Ni 60 ] 2.8 [ Ni 61 ] 7.60 - [ Ni 62 ] -8.7 [ Ni 64 ] -0.37 [ Cu . ] 7.718 - [ Cu 63 ] 6.43 [ Cu 65 ] 10.61 [ Zn . ] 5.680 - [ Zn 64 ] 5.22 [ Zn 66 ] 5.97 [ Zn 67 ] 7.56 - [ Zn 68 ] 6.03 [ Zn 70 ] 6. [ Ga . ] 7.288 - [ Ga 69 ] 7.88 [ Ga 71 ] 6.40 [ Ge . ] 8.185 - [ Ge 70 ] 10.0 [ Ge 72 ] 8.51 [ Ge 73 ] 5.02 - [ Ge 74 ] 7.58 [ Ge 76 ] 8.2 [ As . ] 6.58 - [ As 75 ] 6.58 [ Se . ] 7.970 [ Se 74 ] 0.8 - [ Se 76 ] 12.2 [ Se 77 ] 8.25 [ Se 78 ] 8.24 - [ Se 80 ] 7.48 [ Se 82 ] 6.34 [ Br . ] 6.795 - [ Br 79 ] 6.8 [ Br 81 ] 6.79 [ Kr . ] 7.81 - [ Kr 78 ] ? [ Kr 80 ] ? [ Kr 82 ] ? - [ Kr 83 ] ? [ Kr 84 ] ? [ Kr 86 ] 8.1 - [ Rb . ] 7.09 [ Rb 85 ] 7.03 [ Rb 87 ] 7.23 - [ Sr . ] 7.02 [ Sr 84 ] 7. [ Sr 86 ] 5.67 - [ Sr 87 ] 7.40 [ Sr 88 ] 7.15 [ Y . ] 7.75 - [ Y 89 ] 7.75 [ Zr . ] 7.16 [ Zr 90 ] 6.4 - [ Zr 91 ] 8.7 [ Zr 92 ] 7.4 [ Zr 94 ] 8.2 - [ Zr 96 ] 5.5 [ Nb . ] 7.054 [ Nb 93 ] 7.054 - [ Mo . ] 6.715 [ Mo 92 ] 6.91 [ Mo 94 ] 6.80 - [ Mo 95 ] 6.91 [ Mo 96 ] 6.20 [ Mo 97 ] 7.24 - [ Mo 98 ] 6.58 [ Mo 100 ] 6.73 [ Tc . ] ? - [ Tc 99 ] 6.8 [ Ru . ] 7.03 [ Ru 96 ] ? - [ Ru 98 ] ? [ Ru 99 ] ? [ Ru 100 ] ? - [ Ru 101 ] ? [ Ru 102 ] ? [ Ru 104 ] ? - [ Rh . ] 5.88 [ Rh 103 ] 5.88 [ Pd . ] 5.91 - [ Pd 102 ] 7.7 [ Pd 104 ] 7.7 [ Pd 105 ] 5.5 - [ Pd 106 ] 6.4 [ Pd 108 ] 4.1 [ Pd 110 ] 7.7 - [ Ag . ] 5.922 [ Ag 107 ] 7.555 [ Ag 109 ] 4.165 - [ Cd . ] 4.87-0.70i [ Cd 106 ] 5. [ Cd 108 ] 5.4 - [ Cd 110 ] 5.9 [ Cd 111 ] 6.5 [ Cd 112 ] 6.4 - [ Cd 113 ] -8.0-5.73i [ Cd 114 ] 7.5 [ Cd 116 ] 6.3 - [ In . ] 4.065-0.0539i [ In 113 ] 5.39 [ In 115 ] 4.01-0.0562i - [ Sn . ] 6.225 [ Sn 112 ] 6. [ Sn 114 ] 6.2 - [ Sn 115 ] 6. [ Sn 116 ] 5.93 [ Sn 117 ] 6.48 - [ Sn 118 ] 6.07 [ Sn 119 ] 6.12 [ Sn 120 ] 6.49 - [ Sn 122 ] 5.74 [ Sn 124 ] 5.97 [ Sb . ] 5.57 - [ Sb 121 ] 5.71 [ Sb 123 ] 5.38 [ Te . ] 5.80 - [ Te 120 ] 5.3 [ Te 122 ] 3.8 [ Te 123 ] -0.05-0.116i - [ Te 124 ] 7.96 [ Te 125 ] 5.02 [ Te 126 ] 5.56 - [ Te 128 ] 5.89 [ Te 130 ] 6.02 [ I . ] 5.28 - [ I 127 ] 5.28 [ Xe . ] 4.92 [ Xe 124 ] ? - [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? - [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? - [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42 - [ Cs 133 ] 5.42 [ Ba . ] 5.07 [ Ba 130 ] -3.6 - [ Ba 132 ] 7.8 [ Ba 134 ] 5.7 [ Ba 135 ] 4.67 - [ Ba 136 ] 4.91 [ Ba 137 ] 6.83 [ Ba 138 ] 4.84 - [ La . ] 8.24 [ La 138 ] 8. [ La 139 ] 8.24 - [ Ce . ] 4.84 [ Ce 136 ] 5.80 [ Ce 138 ] 6.70 - [ Ce 140 ] 4.84 [ Ce 142 ] 4.75 [ Pr . ] 4.58 - [ Pr 141 ] 4.58 [ Nd . ] 7.69 [ Nd 142 ] 7.7 - [ Nd 143 ] 14. [ Nd 144 ] 2.8 [ Nd 145 ] 14. - [ Nd 146 ] 8.7 [ Nd 148 ] 5.7 [ Nd 150 ] 5.3 - [ Pm . ] ? [ Pm 147 ] 12.6 [ Sm . ] 0.80-1.65i - [ Sm 144 ] -3. [ Sm 147 ] 14. [ Sm 148 ] -3. - [ Sm 149 ] -19.2-11.7i [ Sm 150 ] 14. [ Sm 152 ] -5.00 - [ Sm 154 ] 9.3 [ Eu . ] 7.22-1.26i [ Eu 151 ] 6.13-2.53i - [ Eu 153 ] 8.22 [ Gd . ] 6.5-13.82i [ Gd 152 ] 10. - [ Gd 154 ] 10. [ Gd 155 ] 6.0-17.0i [ Gd 156 ] 6.3 - [ Gd 157 ] -1.14-71.9i [ Gd 158 ] 9. [ Gd 160 ] 9.15 - [ Tb . ] 7.38 [ Tb 159 ] 7.38 [ Dy . ] 16.9-0.276i - [ Dy 156 ] 6.1 [ Dy 158 ] 6. [ Dy 160 ] 6.7 - [ Dy 161 ] 10.3 [ Dy 162 ] -1.4 [ Dy 163 ] 5.0 - [ Dy 164 ] 49.4-0.79i [ Ho . ] 8.01 [ Ho 165 ] 8.01 - [ Er . ] 7.79 [ Er 162 ] 8.8 [ Er 164 ] 8.2 - [ Er 166 ] 10.6 [ Er 167 ] 3.0 [ Er 168 ] 7.4 - [ Er 170 ] 9.6 [ Tm . ] 7.07 [ Tm 169 ] 7.07 - [ Yb . ] 12.43 [ Yb 168 ] -4.07-0.62i [ Yb 170 ] 6.77 - [ Yb 171 ] 9.66 [ Yb 172 ] 9.43 [ Yb 173 ] 9.56 - [ Yb 174 ] 19.3 [ Yb 176 ] 8.72 [ Lu . ] 7.21 - [ Lu 175 ] 7.24 [ Lu 176 ] 6.1-0.57i [ Hf . ] 7.7 - [ Hf 174 ] 10.9 [ Hf 176 ] 6.61 [ Hf 177 ] 0.8 - [ Hf 178 ] 5.9 [ Hf 179 ] 7.46 [ Hf 180 ] 13.2 - [ Ta . ] 6.91 [ Ta 180 ] 7. [ Ta 181 ] 6.91 - [ W . ] 4.86 [ W 180 ] 5. [ W 182 ] 6.97 - [ W 183 ] 6.53 [ W 184 ] 7.48 [ W 186 ] -0.72 - [ Re . ] 9.2 [ Re 185 ] 9.0 [ Re 187 ] 9.3 - [ Os . ] 10.7 [ Os 184 ] 10. [ Os 186 ] 11.6 - [ Os 187 ] 10. [ Os 188 ] 7.6 [ Os 189 ] 10.7 - [ Os 190 ] 11.0 [ Os 192 ] 11.5 [ Ir . ] 10.6 - [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6 - [ Pt 190 ] 9.0 [ Pt 192 ] 9.9 [ Pt 194 ] 10.55 - [ Pt 195 ] 8.83 [ Pt 196 ] 9.89 [ Pt 198 ] 7.8 - [ Au . ] 7.63 [ Au 197 ] 7.63 [ Hg . ] 12.692 - [ Hg 196 ] 30.3 [ Hg 198 ] ? [ Hg 199 ] 16.9 - [ Hg 200 ] ? [ Hg 201 ] ? [ Hg 202 ] ? - [ Hg 204 ] ? [ Tl . ] 8.776 [ Tl 203 ] 6.99 - [ Tl 205 ] 9.52 [ Pb . ] 9.405 [ Pb 204 ] 9.90 - [ Pb 206 ] 9.22 [ Pb 207 ] 9.28 [ Pb 208 ] 9.50 - [ Bi . ] 8.532 [ Bi 209 ] 8.532 [ Po . ] ? - [ At . ] ? [ Rn . ] ? [ Fr . ] ? - [ Ra . ] ? [ Ra 226 ] 10.0 [ Ac . ] ? - [ Th . ] ? [ Th 232 ] 10.31 [ Pa . ] 9.1 - [ Pa 231 ] 9.1 [ U . ] 8.417 [ U 233 ] 10.1 - [ U 234 ] 12.4 [ U 235 ] 10.47 [ U 238 ] 8.402 - [ Np . ] ? [ Np 237 ] 10.55 [ Pu . ] ? - [ Pu 238 ] 14.1 [ Pu 239 ] 7.7 [ Pu 240 ] 3.5 - [ Pu 242 ] 8.1 [ Am . ] ? [ Am 243 ] 8.3 - [ Cm . ] ? [ Cm 244 ] 9.5 [ Cm 246 ] 9.3 - [ Cm 248 ] 7.7 + [ H . ] -3.7390(11) [ H 1 ] -3.7406(11) [ H 2 ] 6.671(4) + [ D . ] 6.671(4) [ D 2 ] 6.671(4) [ H 3 ] 4.792(27) + [ He . ] 3.26(3) [ He 3 ] 5.74(7)-1.483(2)i [ He 4 ] 3.26(3) + [ Li . ] -1.90(2) [ Li 6 ] 2.00(11)-0.261(1)i [ Li 7 ] -2.22(2) + [ Be . ] 7.79(1) [ Be 9 ] 7.79(1) [ B . ] 5.30(4)-0.213(2)i + [ B 10 ] -0.1(3)-1.066(3)i [ B 11 ] 6.65(4) [ C . ] 6.6460(12) + [ C 12 ] 6.6511(16) [ C 13 ] 6.19(9) [ N . ] 9.36(2) + [ N 14 ] 9.37(2) [ N 15 ] 6.44(3) [ O . ] 5.803(4) + [ O 16 ] 5.803(4) [ O 17 ] 5.78(15) [ O 18 ] 5.84(7) + [ F . ] 5.654(10) [ F 19 ] 5.654(10) [ Ne . ] 4.566(6) + [ Ne 20 ] 4.631(6) [ Ne 21 ] 6.66(19) [ Ne 22 ] 3.87(1) + [ Na . ] 3.63(2) [ Na 23 ] 3.63(2) [ Mg . ] 5.375(4) + [ Mg 24 ] 5.66(3) [ Mg 25 ] 3.62(14) [ Mg 26 ] 4.89(15) + [ Al . ] 3.449(5) [ Al 27 ] 3.449(5) [ Si . ] 4.1491(10) + [ Si 28 ] 4.107(6) [ Si 29 ] 4.7(10) [ Si 30 ] 4.58(8) + [ P . ] 5.13(1) [ P 31 ] 5.13(1) [ S . ] 2.847(1) + [ S 32 ] 2.804(2) [ S 33 ] 4.74(19) [ S 34 ] 3.48(3) + [ S 36 ] 3.(1) [ Cl . ] 9.5770(8) [ Cl 35 ] 11.65(2) + [ Cl 37 ] 3.08(6) [ Ar . ] 1.909(6) [ Ar 36 ] 24.9(7) + [ Ar 38 ] 3.5(35) [ Ar 40 ] 1.83(6) [ K . ] 3.67(2) + [ K 39 ] 3.74(2) [ K 40 ] 3.(1) [ K 41 ] 2.69(8) + [ Ca . ] 4.70(2) [ Ca 40 ] 4.80(2) [ Ca 42 ] 3.36(10) + [ Ca 43 ] -1.56(9) [ Ca 44 ] 1.42(6) [ Ca 46 ] 3.6(2) + [ Ca 48 ] 0.39(9) [ Sc . ] 12.29(11) [ Sc 45 ] 12.29(11) + [ Ti . ] -3.438(2) [ Ti 46 ] 4.93(6) [ Ti 47 ] 3.63(12) + [ Ti 48 ] -6.08(2) [ Ti 49 ] 1.04(5) [ Ti 50 ] 6.18(8) + [ V . ] -0.3824(12) [ V 50 ] 7.6(6) [ V 51 ] -0.402(2) + [ Cr . ] 3.635(7) [ Cr 50 ] -4.5(5) [ Cr 52 ] 4.920(10) + [ Cr 53 ] -4.20(3) [ Cr 54 ] 4.55(10) [ Mn . ] -3.73(2) + [ Mn 55 ] -3.73(2) [ Fe . ] 9.45(2) [ Fe 54 ] 4.2(1) + [ Fe 56 ] 9.94(3) [ Fe 57 ] 2.3(1) [ Fe 58 ] 15.(7) + [ Co . ] 2.49(2) [ Co 59 ] 2.49(2) [ Ni . ] 10.3(1) + [ Ni 58 ] 14.4(1) [ Ni 60 ] 2.8(1) [ Ni 61 ] 7.60(6) + [ Ni 62 ] -8.7(2) [ Ni 64 ] -0.37(7) [ Cu . ] 7.718(4) + [ Cu 63 ] 6.43(15) [ Cu 65 ] 10.61(19) [ Zn . ] 5.680(5) + [ Zn 64 ] 5.22(4) [ Zn 66 ] 5.97(5) [ Zn 67 ] 7.56(8) + [ Zn 68 ] 6.03(3) [ Zn 70 ] 6.(1) [ Ga . ] 7.288(2) + [ Ga 69 ] 7.88(2) [ Ga 71 ] 6.40(3) [ Ge . ] 8.185(20) + [ Ge 70 ] 10.0(1) [ Ge 72 ] 8.51(10) [ Ge 73 ] 5.02(4) + [ Ge 74 ] 7.58(10) [ Ge 76 ] 8.2(15) [ As . ] 6.58(1) + [ As 75 ] 6.58(1) [ Se . ] 7.970(9) [ Se 74 ] 0.8(30) + [ Se 76 ] 12.2(1) [ Se 77 ] 8.25(8) [ Se 78 ] 8.24(9) + [ Se 80 ] 7.48(3) [ Se 82 ] 6.34(8) [ Br . ] 6.795(15) + [ Br 79 ] 6.8(7) [ Br 81 ] 6.79(7) [ Kr . ] 7.81(2) + [ Kr 78 ] ? [ Kr 80 ] ? [ Kr 82 ] ? + [ Kr 83 ] ? [ Kr 84 ] ? [ Kr 86 ] 8.1(2) + [ Rb . ] 7.09(2) [ Rb 85 ] 7.03(10) [ Rb 87 ] 7.23(12) + [ Sr . ] 7.02(2) [ Sr 84 ] 7.(1) [ Sr 86 ] 5.67(5) + [ Sr 87 ] 7.40(7) [ Sr 88 ] 7.15(6) [ Y . ] 7.75(2) + [ Y 89 ] 7.75(2) [ Zr . ] 7.16(3) [ Zr 90 ] 6.4(1) + [ Zr 91 ] 8.7(1) [ Zr 92 ] 7.4(2) [ Zr 94 ] 8.2(2) + [ Zr 96 ] 5.5(1) [ Nb . ] 7.054(3) [ Nb 93 ] 7.054(3) + [ Mo . ] 6.715(20) [ Mo 92 ] 6.91(8) [ Mo 94 ] 6.80(7) + [ Mo 95 ] 6.91(6) [ Mo 96 ] 6.20(6) [ Mo 97 ] 7.24(8) + [ Mo 98 ] 6.58(7) [ Mo 100 ] 6.73(7) [ Tc . ] ? + [ Tc 99 ] 6.8(3) [ Ru . ] 7.03(3) [ Ru 96 ] ? + [ Ru 98 ] ? [ Ru 99 ] ? [ Ru 100 ] ? + [ Ru 101 ] ? [ Ru 102 ] ? [ Ru 104 ] ? + [ Rh . ] 5.88(4) [ Rh 103 ] 5.88(4) [ Pd . ] 5.91(6) + [ Pd 102 ] 7.7(7) [ Pd 104 ] 7.7(7) [ Pd 105 ] 5.5(3) + [ Pd 106 ] 6.4(4) [ Pd 108 ] 4.1(3) [ Pd 110 ] 7.7(7) + [ Ag . ] 5.922(7) [ Ag 107 ] 7.555(11) [ Ag 109 ] 4.165(11) + [ Cd . ] 4.87(5)-0.70(1)i [ Cd 106 ] 5.(2) [ Cd 108 ] 5.4(1) + [ Cd 110 ] 5.9(1) [ Cd 111 ] 6.5(1) [ Cd 112 ] 6.4(1) + [ Cd 113 ] -8.0(2)-5.73(11)i [ Cd 114 ] 7.5(1) [ Cd 116 ] 6.3(1) + [ In . ] 4.065(20)-0.0539(4)i [ In 113 ] 5.39(6) [ In 115 ] 4.01(2)-0.0562(6)i + [ Sn . ] 6.225(2) [ Sn 112 ] 6.(1) [ Sn 114 ] 6.2(3) + [ Sn 115 ] 6.(1) [ Sn 116 ] 5.93(5) [ Sn 117 ] 6.48(5) + [ Sn 118 ] 6.07(5) [ Sn 119 ] 6.12(5) [ Sn 120 ] 6.49(5) + [ Sn 122 ] 5.74(5) [ Sn 124 ] 5.97(5) [ Sb . ] 5.57(3) + [ Sb 121 ] 5.71(6) [ Sb 123 ] 5.38(7) [ Te . ] 5.80(3) + [ Te 120 ] 5.3(5) [ Te 122 ] 3.8(2) [ Te 123 ] -0.05(25)-0.116(8)i + [ Te 124 ] 7.96(10) [ Te 125 ] 5.02(8) [ Te 126 ] 5.56(7) + [ Te 128 ] 5.89(7) [ Te 130 ] 6.02(7) [ I . ] 5.28(2) + [ I 127 ] 5.28(2) [ Xe . ] 4.92(3) [ Xe 124 ] ? + [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? + [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? + [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42(2) + [ Cs 133 ] 5.42(2) [ Ba . ] 5.07(3) [ Ba 130 ] -3.6(6) + [ Ba 132 ] 7.8(3) [ Ba 134 ] 5.7(1) [ Ba 135 ] 4.67(10) + [ Ba 136 ] 4.91(8) [ Ba 137 ] 6.83(10) [ Ba 138 ] 4.84(8) + [ La . ] 8.24(4) [ La 138 ] 8.(2) [ La 139 ] 8.24(4) + [ Ce . ] 4.84(2) [ Ce 136 ] 5.80(9) [ Ce 138 ] 6.70(9) + [ Ce 140 ] 4.84(9) [ Ce 142 ] 4.75(9) [ Pr . ] 4.58(5) + [ Pr 141 ] 4.58(5) [ Nd . ] 7.69(5) [ Nd 142 ] 7.7(3) + [ Nd 143 ] 14.(2) [ Nd 144 ] 2.8(3) [ Nd 145 ] 14.(2) + [ Nd 146 ] 8.7(2) [ Nd 148 ] 5.7(3) [ Nd 150 ] 5.3(2) + [ Pm . ] ? [ Pm 147 ] 12.6(4) [ Sm . ] 0.80(2)-1.65(2)i + [ Sm 144 ] -3.(4) [ Sm 147 ] 14.(3) [ Sm 148 ] -3.(4) + [ Sm 149 ] -19.2(1)-11.7(1)i [ Sm 150 ] 14.(3) [ Sm 152 ] -5.00(6) + [ Sm 154 ] 9.3(10) [ Eu . ] 7.22(2)-1.26(1)i [ Eu 151 ] 6.13(14)-2.53(3)i + [ Eu 153 ] 8.22(12) [ Gd . ] 6.5(5)-13.82(3)i [ Gd 152 ] 10.(3) + [ Gd 154 ] 10.(3) [ Gd 155 ] 6.0(1)-17.0(1)i [ Gd 156 ] 6.3(4) + [ Gd 157 ] -1.14(2)-71.9(2)i [ Gd 158 ] 9.(2) [ Gd 160 ] 9.15(5) + [ Tb . ] 7.38(3) [ Tb 159 ] 7.38(3) [ Dy . ] 16.9(2)-0.276(4)i + [ Dy 156 ] 6.1(5) [ Dy 158 ] 6.(4) [ Dy 160 ] 6.7(4) + [ Dy 161 ] 10.3(4) [ Dy 162 ] -1.4(5) [ Dy 163 ] 5.0(4) + [ Dy 164 ] 49.4(2)-0.79(1)i [ Ho . ] 8.01(8) [ Ho 165 ] 8.01(8) + [ Er . ] 7.79(2) [ Er 162 ] 8.8(2) [ Er 164 ] 8.2(2) + [ Er 166 ] 10.6(2) [ Er 167 ] 3.0(3) [ Er 168 ] 7.4(4) + [ Er 170 ] 9.6(5) [ Tm . ] 7.07(3) [ Tm 169 ] 7.07(3) + [ Yb . ] 12.43(3) [ Yb 168 ] -4.07(2)-0.62(1)i [ Yb 170 ] 6.77(10) + [ Yb 171 ] 9.66(10) [ Yb 172 ] 9.43(10) [ Yb 173 ] 9.56(7) + [ Yb 174 ] 19.3(1) [ Yb 176 ] 8.72(10) [ Lu . ] 7.21(3) + [ Lu 175 ] 7.24(3) [ Lu 176 ] 6.1(1)-0.57(1)i [ Hf . ] 7.7(14) + [ Hf 174 ] 10.9(11) [ Hf 176 ] 6.61(18) [ Hf 177 ] 0.8(10) + [ Hf 178 ] 5.9(2) [ Hf 179 ] 7.46(16) [ Hf 180 ] 13.2(3) + [ Ta . ] 6.91(7) [ Ta 180 ] 7.(2) [ Ta 181 ] 6.91(7) + [ W . ] 4.86(2) [ W 180 ] 5.(3) [ W 182 ] 6.97(4) + [ W 183 ] 6.53(4) [ W 184 ] 7.48(6) [ W 186 ] -0.72(4) + [ Re . ] 9.2(2) [ Re 185 ] 9.0(3) [ Re 187 ] 9.3(3) + [ Os . ] 10.7(2) [ Os 184 ] 10.(2) [ Os 186 ] 11.6(17) + [ Os 187 ] 10.(2) [ Os 188 ] 7.6(3) [ Os 189 ] 10.7(3) + [ Os 190 ] 11.0(3) [ Os 192 ] 11.5(4) [ Ir . ] 10.6(3) + [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6(1) + [ Pt 190 ] 9.0(10) [ Pt 192 ] 9.9(5) [ Pt 194 ] 10.55(8) + [ Pt 195 ] 8.83(11) [ Pt 196 ] 9.89(8) [ Pt 198 ] 7.8(1) + [ Au . ] 7.63(6) [ Au 197 ] 7.63(6) [ Hg . ] 12.692(15) + [ Hg 196 ] 30.3(10) [ Hg 198 ] ? [ Hg 199 ] 16.9(4) + [ Hg 200 ] ? [ Hg 201 ] ? [ Hg 202 ] ? + [ Hg 204 ] ? [ Tl . ] 8.776(5) [ Tl 203 ] 6.99(16) + [ Tl 205 ] 9.52(7) [ Pb . ] 9.405(3) [ Pb 204 ] 9.90(10) + [ Pb 206 ] 9.22(5) [ Pb 207 ] 9.28(4) [ Pb 208 ] 9.50(2) + [ Bi . ] 8.532(2) [ Bi 209 ] 8.532(2) [ Po . ] ? + [ At . ] ? [ Rn . ] ? [ Fr . ] ? + [ Ra . ] ? [ Ra 226 ] 10.0(10) [ Ac . ] ? + [ Th . ] ? [ Th 232 ] 10.31(3) [ Pa . ] 9.1(3) + [ Pa 231 ] 9.1(3) [ U . ] 8.417(5) [ U 233 ] 10.1(2) + [ U 234 ] 12.4(3) [ U 235 ] 10.47(4) [ U 238 ] 8.402(5) + [ Np . ] ? [ Np 237 ] 10.55(10) [ Pu . ] ? + [ Pu 238 ] 14.1(5) [ Pu 239 ] 7.7(1) [ Pu 240 ] 3.5(1) + [ Pu 242 ] 8.1(1) [ Am . ] ? [ Am 243 ] 8.3(2) + [ Cm . ] ? [ Cm 244 ] 9.5(3) [ Cm 246 ] 9.3(2) + [ Cm 248 ] 7.7(2) save_ From 7a36dbc5f7f90f4efed8b13e42fbbcdae72dfba9 Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 19:51:36 +0800 Subject: [PATCH 7/9] update values to match ITC table 4.4.4.1 3rd ed --- templ_enum.cif | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index d6062f1..7aaea88 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1180,12 +1180,12 @@ save_length_neutron [ Ca . ] 4.70(2) [ Ca 40 ] 4.80(2) [ Ca 42 ] 3.36(10) [ Ca 43 ] -1.56(9) [ Ca 44 ] 1.42(6) [ Ca 46 ] 3.6(2) [ Ca 48 ] 0.39(9) [ Sc . ] 12.29(11) [ Sc 45 ] 12.29(11) - [ Ti . ] -3.438(2) [ Ti 46 ] 4.93(6) [ Ti 47 ] 3.63(12) - [ Ti 48 ] -6.08(2) [ Ti 49 ] 1.04(5) [ Ti 50 ] 6.18(8) + [ Ti . ] -3.370(13) [ Ti 46 ] 4.725(5) [ Ti 47 ] 3.53(7) + [ Ti 48 ] -5.86(2) [ Ti 49 ] 0.98(5) [ Ti 50 ] 5.88(10) [ V . ] -0.3824(12) [ V 50 ] 7.6(6) [ V 51 ] -0.402(2) [ Cr . ] 3.635(7) [ Cr 50 ] -4.5(5) [ Cr 52 ] 4.920(10) - [ Cr 53 ] -4.20(3) [ Cr 54 ] 4.55(10) [ Mn . ] -3.73(2) - [ Mn 55 ] -3.73(2) [ Fe . ] 9.45(2) [ Fe 54 ] 4.2(1) + [ Cr 53 ] -4.20(3) [ Cr 54 ] 4.55(10) [ Mn . ] -3.750(18) + [ Mn 55 ] -3.750(18) [ Fe . ] 9.45(2) [ Fe 54 ] 4.2(1) [ Fe 56 ] 9.94(3) [ Fe 57 ] 2.3(1) [ Fe 58 ] 15.(7) [ Co . ] 2.49(2) [ Co 59 ] 2.49(2) [ Ni . ] 10.3(1) [ Ni 58 ] 14.4(1) [ Ni 60 ] 2.8(1) [ Ni 61 ] 7.60(6) From 856a44e93ab395c577c0cabc5e1317784422e8f1 Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 20:11:46 +0800 Subject: [PATCH 8/9] add _enumeration_source.reference --- templ_enum.cif | 275 +++++++++++++++++++++++++------------------------ 1 file changed, 141 insertions(+), 134 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index 7aaea88..01097ad 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1153,143 +1153,150 @@ save_length_neutron _units.code femtometres + loop_ + _enumeration_source.id + _enumeration_source.reference + a 'International Tables Vol. C Table 4.4.4.1 3rd ed. and Sears, V.F. (1992) Neutron News, 3(3), pp. 26-37.' + b 'International Tables Vol. C Table 4.4.4.1 3rd ed.' + loop_ _enumeration_defaults.index _enumeration_defaults.value - [ H . ] -3.7390(11) [ H 1 ] -3.7406(11) [ H 2 ] 6.671(4) - [ D . ] 6.671(4) [ D 2 ] 6.671(4) [ H 3 ] 4.792(27) - [ He . ] 3.26(3) [ He 3 ] 5.74(7)-1.483(2)i [ He 4 ] 3.26(3) - [ Li . ] -1.90(2) [ Li 6 ] 2.00(11)-0.261(1)i [ Li 7 ] -2.22(2) - [ Be . ] 7.79(1) [ Be 9 ] 7.79(1) [ B . ] 5.30(4)-0.213(2)i - [ B 10 ] -0.1(3)-1.066(3)i [ B 11 ] 6.65(4) [ C . ] 6.6460(12) - [ C 12 ] 6.6511(16) [ C 13 ] 6.19(9) [ N . ] 9.36(2) - [ N 14 ] 9.37(2) [ N 15 ] 6.44(3) [ O . ] 5.803(4) - [ O 16 ] 5.803(4) [ O 17 ] 5.78(15) [ O 18 ] 5.84(7) - [ F . ] 5.654(10) [ F 19 ] 5.654(10) [ Ne . ] 4.566(6) - [ Ne 20 ] 4.631(6) [ Ne 21 ] 6.66(19) [ Ne 22 ] 3.87(1) - [ Na . ] 3.63(2) [ Na 23 ] 3.63(2) [ Mg . ] 5.375(4) - [ Mg 24 ] 5.66(3) [ Mg 25 ] 3.62(14) [ Mg 26 ] 4.89(15) - [ Al . ] 3.449(5) [ Al 27 ] 3.449(5) [ Si . ] 4.1491(10) - [ Si 28 ] 4.107(6) [ Si 29 ] 4.7(10) [ Si 30 ] 4.58(8) - [ P . ] 5.13(1) [ P 31 ] 5.13(1) [ S . ] 2.847(1) - [ S 32 ] 2.804(2) [ S 33 ] 4.74(19) [ S 34 ] 3.48(3) - [ S 36 ] 3.(1) [ Cl . ] 9.5770(8) [ Cl 35 ] 11.65(2) - [ Cl 37 ] 3.08(6) [ Ar . ] 1.909(6) [ Ar 36 ] 24.9(7) - [ Ar 38 ] 3.5(35) [ Ar 40 ] 1.83(6) [ K . ] 3.67(2) - [ K 39 ] 3.74(2) [ K 40 ] 3.(1) [ K 41 ] 2.69(8) - [ Ca . ] 4.70(2) [ Ca 40 ] 4.80(2) [ Ca 42 ] 3.36(10) - [ Ca 43 ] -1.56(9) [ Ca 44 ] 1.42(6) [ Ca 46 ] 3.6(2) - [ Ca 48 ] 0.39(9) [ Sc . ] 12.29(11) [ Sc 45 ] 12.29(11) - [ Ti . ] -3.370(13) [ Ti 46 ] 4.725(5) [ Ti 47 ] 3.53(7) - [ Ti 48 ] -5.86(2) [ Ti 49 ] 0.98(5) [ Ti 50 ] 5.88(10) - [ V . ] -0.3824(12) [ V 50 ] 7.6(6) [ V 51 ] -0.402(2) - [ Cr . ] 3.635(7) [ Cr 50 ] -4.5(5) [ Cr 52 ] 4.920(10) - [ Cr 53 ] -4.20(3) [ Cr 54 ] 4.55(10) [ Mn . ] -3.750(18) - [ Mn 55 ] -3.750(18) [ Fe . ] 9.45(2) [ Fe 54 ] 4.2(1) - [ Fe 56 ] 9.94(3) [ Fe 57 ] 2.3(1) [ Fe 58 ] 15.(7) - [ Co . ] 2.49(2) [ Co 59 ] 2.49(2) [ Ni . ] 10.3(1) - [ Ni 58 ] 14.4(1) [ Ni 60 ] 2.8(1) [ Ni 61 ] 7.60(6) - [ Ni 62 ] -8.7(2) [ Ni 64 ] -0.37(7) [ Cu . ] 7.718(4) - [ Cu 63 ] 6.43(15) [ Cu 65 ] 10.61(19) [ Zn . ] 5.680(5) - [ Zn 64 ] 5.22(4) [ Zn 66 ] 5.97(5) [ Zn 67 ] 7.56(8) - [ Zn 68 ] 6.03(3) [ Zn 70 ] 6.(1) [ Ga . ] 7.288(2) - [ Ga 69 ] 7.88(2) [ Ga 71 ] 6.40(3) [ Ge . ] 8.185(20) - [ Ge 70 ] 10.0(1) [ Ge 72 ] 8.51(10) [ Ge 73 ] 5.02(4) - [ Ge 74 ] 7.58(10) [ Ge 76 ] 8.2(15) [ As . ] 6.58(1) - [ As 75 ] 6.58(1) [ Se . ] 7.970(9) [ Se 74 ] 0.8(30) - [ Se 76 ] 12.2(1) [ Se 77 ] 8.25(8) [ Se 78 ] 8.24(9) - [ Se 80 ] 7.48(3) [ Se 82 ] 6.34(8) [ Br . ] 6.795(15) - [ Br 79 ] 6.8(7) [ Br 81 ] 6.79(7) [ Kr . ] 7.81(2) - [ Kr 78 ] ? [ Kr 80 ] ? [ Kr 82 ] ? - [ Kr 83 ] ? [ Kr 84 ] ? [ Kr 86 ] 8.1(2) - [ Rb . ] 7.09(2) [ Rb 85 ] 7.03(10) [ Rb 87 ] 7.23(12) - [ Sr . ] 7.02(2) [ Sr 84 ] 7.(1) [ Sr 86 ] 5.67(5) - [ Sr 87 ] 7.40(7) [ Sr 88 ] 7.15(6) [ Y . ] 7.75(2) - [ Y 89 ] 7.75(2) [ Zr . ] 7.16(3) [ Zr 90 ] 6.4(1) - [ Zr 91 ] 8.7(1) [ Zr 92 ] 7.4(2) [ Zr 94 ] 8.2(2) - [ Zr 96 ] 5.5(1) [ Nb . ] 7.054(3) [ Nb 93 ] 7.054(3) - [ Mo . ] 6.715(20) [ Mo 92 ] 6.91(8) [ Mo 94 ] 6.80(7) - [ Mo 95 ] 6.91(6) [ Mo 96 ] 6.20(6) [ Mo 97 ] 7.24(8) - [ Mo 98 ] 6.58(7) [ Mo 100 ] 6.73(7) [ Tc . ] ? - [ Tc 99 ] 6.8(3) [ Ru . ] 7.03(3) [ Ru 96 ] ? - [ Ru 98 ] ? [ Ru 99 ] ? [ Ru 100 ] ? - [ Ru 101 ] ? [ Ru 102 ] ? [ Ru 104 ] ? - [ Rh . ] 5.88(4) [ Rh 103 ] 5.88(4) [ Pd . ] 5.91(6) - [ Pd 102 ] 7.7(7) [ Pd 104 ] 7.7(7) [ Pd 105 ] 5.5(3) - [ Pd 106 ] 6.4(4) [ Pd 108 ] 4.1(3) [ Pd 110 ] 7.7(7) - [ Ag . ] 5.922(7) [ Ag 107 ] 7.555(11) [ Ag 109 ] 4.165(11) - [ Cd . ] 4.87(5)-0.70(1)i [ Cd 106 ] 5.(2) [ Cd 108 ] 5.4(1) - [ Cd 110 ] 5.9(1) [ Cd 111 ] 6.5(1) [ Cd 112 ] 6.4(1) - [ Cd 113 ] -8.0(2)-5.73(11)i [ Cd 114 ] 7.5(1) [ Cd 116 ] 6.3(1) - [ In . ] 4.065(20)-0.0539(4)i [ In 113 ] 5.39(6) [ In 115 ] 4.01(2)-0.0562(6)i - [ Sn . ] 6.225(2) [ Sn 112 ] 6.(1) [ Sn 114 ] 6.2(3) - [ Sn 115 ] 6.(1) [ Sn 116 ] 5.93(5) [ Sn 117 ] 6.48(5) - [ Sn 118 ] 6.07(5) [ Sn 119 ] 6.12(5) [ Sn 120 ] 6.49(5) - [ Sn 122 ] 5.74(5) [ Sn 124 ] 5.97(5) [ Sb . ] 5.57(3) - [ Sb 121 ] 5.71(6) [ Sb 123 ] 5.38(7) [ Te . ] 5.80(3) - [ Te 120 ] 5.3(5) [ Te 122 ] 3.8(2) [ Te 123 ] -0.05(25)-0.116(8)i - [ Te 124 ] 7.96(10) [ Te 125 ] 5.02(8) [ Te 126 ] 5.56(7) - [ Te 128 ] 5.89(7) [ Te 130 ] 6.02(7) [ I . ] 5.28(2) - [ I 127 ] 5.28(2) [ Xe . ] 4.92(3) [ Xe 124 ] ? - [ Xe 126 ] ? [ Xe 128 ] ? [ Xe 129 ] ? - [ Xe 130 ] ? [ Xe 131 ] ? [ Xe 132 ] ? - [ Xe 134 ] ? [ Xe 136 ] ? [ Cs . ] 5.42(2) - [ Cs 133 ] 5.42(2) [ Ba . ] 5.07(3) [ Ba 130 ] -3.6(6) - [ Ba 132 ] 7.8(3) [ Ba 134 ] 5.7(1) [ Ba 135 ] 4.67(10) - [ Ba 136 ] 4.91(8) [ Ba 137 ] 6.83(10) [ Ba 138 ] 4.84(8) - [ La . ] 8.24(4) [ La 138 ] 8.(2) [ La 139 ] 8.24(4) - [ Ce . ] 4.84(2) [ Ce 136 ] 5.80(9) [ Ce 138 ] 6.70(9) - [ Ce 140 ] 4.84(9) [ Ce 142 ] 4.75(9) [ Pr . ] 4.58(5) - [ Pr 141 ] 4.58(5) [ Nd . ] 7.69(5) [ Nd 142 ] 7.7(3) - [ Nd 143 ] 14.(2) [ Nd 144 ] 2.8(3) [ Nd 145 ] 14.(2) - [ Nd 146 ] 8.7(2) [ Nd 148 ] 5.7(3) [ Nd 150 ] 5.3(2) - [ Pm . ] ? [ Pm 147 ] 12.6(4) [ Sm . ] 0.80(2)-1.65(2)i - [ Sm 144 ] -3.(4) [ Sm 147 ] 14.(3) [ Sm 148 ] -3.(4) - [ Sm 149 ] -19.2(1)-11.7(1)i [ Sm 150 ] 14.(3) [ Sm 152 ] -5.00(6) - [ Sm 154 ] 9.3(10) [ Eu . ] 7.22(2)-1.26(1)i [ Eu 151 ] 6.13(14)-2.53(3)i - [ Eu 153 ] 8.22(12) [ Gd . ] 6.5(5)-13.82(3)i [ Gd 152 ] 10.(3) - [ Gd 154 ] 10.(3) [ Gd 155 ] 6.0(1)-17.0(1)i [ Gd 156 ] 6.3(4) - [ Gd 157 ] -1.14(2)-71.9(2)i [ Gd 158 ] 9.(2) [ Gd 160 ] 9.15(5) - [ Tb . ] 7.38(3) [ Tb 159 ] 7.38(3) [ Dy . ] 16.9(2)-0.276(4)i - [ Dy 156 ] 6.1(5) [ Dy 158 ] 6.(4) [ Dy 160 ] 6.7(4) - [ Dy 161 ] 10.3(4) [ Dy 162 ] -1.4(5) [ Dy 163 ] 5.0(4) - [ Dy 164 ] 49.4(2)-0.79(1)i [ Ho . ] 8.01(8) [ Ho 165 ] 8.01(8) - [ Er . ] 7.79(2) [ Er 162 ] 8.8(2) [ Er 164 ] 8.2(2) - [ Er 166 ] 10.6(2) [ Er 167 ] 3.0(3) [ Er 168 ] 7.4(4) - [ Er 170 ] 9.6(5) [ Tm . ] 7.07(3) [ Tm 169 ] 7.07(3) - [ Yb . ] 12.43(3) [ Yb 168 ] -4.07(2)-0.62(1)i [ Yb 170 ] 6.77(10) - [ Yb 171 ] 9.66(10) [ Yb 172 ] 9.43(10) [ Yb 173 ] 9.56(7) - [ Yb 174 ] 19.3(1) [ Yb 176 ] 8.72(10) [ Lu . ] 7.21(3) - [ Lu 175 ] 7.24(3) [ Lu 176 ] 6.1(1)-0.57(1)i [ Hf . ] 7.7(14) - [ Hf 174 ] 10.9(11) [ Hf 176 ] 6.61(18) [ Hf 177 ] 0.8(10) - [ Hf 178 ] 5.9(2) [ Hf 179 ] 7.46(16) [ Hf 180 ] 13.2(3) - [ Ta . ] 6.91(7) [ Ta 180 ] 7.(2) [ Ta 181 ] 6.91(7) - [ W . ] 4.86(2) [ W 180 ] 5.(3) [ W 182 ] 6.97(4) - [ W 183 ] 6.53(4) [ W 184 ] 7.48(6) [ W 186 ] -0.72(4) - [ Re . ] 9.2(2) [ Re 185 ] 9.0(3) [ Re 187 ] 9.3(3) - [ Os . ] 10.7(2) [ Os 184 ] 10.(2) [ Os 186 ] 11.6(17) - [ Os 187 ] 10.(2) [ Os 188 ] 7.6(3) [ Os 189 ] 10.7(3) - [ Os 190 ] 11.0(3) [ Os 192 ] 11.5(4) [ Ir . ] 10.6(3) - [ Ir 191 ] ? [ Ir 193 ] ? [ Pt . ] 9.6(1) - [ Pt 190 ] 9.0(10) [ Pt 192 ] 9.9(5) [ Pt 194 ] 10.55(8) - [ Pt 195 ] 8.83(11) [ Pt 196 ] 9.89(8) [ Pt 198 ] 7.8(1) - [ Au . ] 7.63(6) [ Au 197 ] 7.63(6) [ Hg . ] 12.692(15) - [ Hg 196 ] 30.3(10) [ Hg 198 ] ? [ Hg 199 ] 16.9(4) - [ Hg 200 ] ? [ Hg 201 ] ? [ Hg 202 ] ? - [ Hg 204 ] ? [ Tl . ] 8.776(5) [ Tl 203 ] 6.99(16) - [ Tl 205 ] 9.52(7) [ Pb . ] 9.405(3) [ Pb 204 ] 9.90(10) - [ Pb 206 ] 9.22(5) [ Pb 207 ] 9.28(4) [ Pb 208 ] 9.50(2) - [ Bi . ] 8.532(2) [ Bi 209 ] 8.532(2) [ Po . ] ? - [ At . ] ? [ Rn . ] ? [ Fr . ] ? - [ Ra . ] ? [ Ra 226 ] 10.0(10) [ Ac . ] ? - [ Th . ] ? [ Th 232 ] 10.31(3) [ Pa . ] 9.1(3) - [ Pa 231 ] 9.1(3) [ U . ] 8.417(5) [ U 233 ] 10.1(2) - [ U 234 ] 12.4(3) [ U 235 ] 10.47(4) [ U 238 ] 8.402(5) - [ Np . ] ? [ Np 237 ] 10.55(10) [ Pu . ] ? - [ Pu 238 ] 14.1(5) [ Pu 239 ] 7.7(1) [ Pu 240 ] 3.5(1) - [ Pu 242 ] 8.1(1) [ Am . ] ? [ Am 243 ] 8.3(2) - [ Cm . ] ? [ Cm 244 ] 9.5(3) [ Cm 246 ] 9.3(2) - [ Cm 248 ] 7.7(2) + _enumeration_defaults.source_id + [ H . ] -3.7390(11) a [ H 1 ] -3.7406(11) a [ H 2 ] 6.671(4) a + [ D . ] 6.671(4) a [ D 2 ] 6.671(4) a [ H 3 ] 4.792(27) a + [ He . ] 3.26(3) a [ He 3 ] 5.74(7)-1.483(2)i a [ He 4 ] 3.26(3) a + [ Li . ] -1.90(2) a [ Li 6 ] 2.00(11)-0.261(1)i a [ Li 7 ] -2.22(2) a + [ Be . ] 7.79(1) a [ Be 9 ] 7.79(1) a [ B . ] 5.30(4)-0.213(2)i a + [ B 10 ] -0.1(3)-1.066(3)i a [ B 11 ] 6.65(4) a [ C . ] 6.6460(12) a + [ C 12 ] 6.6511(16) a [ C 13 ] 6.19(9) a [ N . ] 9.36(2) a + [ N 14 ] 9.37(2) a [ N 15 ] 6.44(3) a [ O . ] 5.803(4) a + [ O 16 ] 5.803(4) a [ O 17 ] 5.78(15) a [ O 18 ] 5.84(7) a + [ F . ] 5.654(10) a [ F 19 ] 5.654(10) a [ Ne . ] 4.566(6) a + [ Ne 20 ] 4.631(6) a [ Ne 21 ] 6.66(19) a [ Ne 22 ] 3.87(1) a + [ Na . ] 3.63(2) a [ Na 23 ] 3.63(2) a [ Mg . ] 5.375(4) a + [ Mg 24 ] 5.66(3) a [ Mg 25 ] 3.62(14) a [ Mg 26 ] 4.89(15) a + [ Al . ] 3.449(5) a [ Al 27 ] 3.449(5) a [ Si . ] 4.1491(10) a + [ Si 28 ] 4.107(6) a [ Si 29 ] 4.7(10) a [ Si 30 ] 4.58(8) a + [ P . ] 5.13(1) a [ P 31 ] 5.13(1) a [ S . ] 2.847(1) a + [ S 32 ] 2.804(2) a [ S 33 ] 4.74(19) a [ S 34 ] 3.48(3) a + [ S 36 ] 3.(1) a [ Cl . ] 9.5770(8) a [ Cl 35 ] 11.65(2) a + [ Cl 37 ] 3.08(6) a [ Ar . ] 1.909(6) a [ Ar 36 ] 24.9(7) a + [ Ar 38 ] 3.5(35) a [ Ar 40 ] 1.83(6) a [ K . ] 3.67(2) a + [ K 39 ] 3.74(2) a [ K 40 ] 3.(1) a [ K 41 ] 2.69(8) a + [ Ca . ] 4.70(2) a [ Ca 40 ] 4.80(2) a [ Ca 42 ] 3.36(10) a + [ Ca 43 ] -1.56(9) a [ Ca 44 ] 1.42(6) a [ Ca 46 ] 3.6(2) a + [ Ca 48 ] 0.39(9) a [ Sc . ] 12.29(11) a [ Sc 45 ] 12.29(11) a + [ Ti . ] -3.370(13) b [ Ti 46 ] 4.725(5) b [ Ti 47 ] 3.53(7) b + [ Ti 48 ] -5.86(2) b [ Ti 49 ] 0.98(5) b [ Ti 50 ] 5.88(10) b + [ V . ] -0.3824(12) a [ V 50 ] 7.6(6) a [ V 51 ] -0.402(2) a + [ Cr . ] 3.635(7) a [ Cr 50 ] -4.5(5) a [ Cr 52 ] 4.920(10) a + [ Cr 53 ] -4.20(3) a [ Cr 54 ] 4.55(10) a [ Mn . ] -3.750(18) b + [ Mn 55 ] -3.750(18) b [ Fe . ] 9.45(2) a [ Fe 54 ] 4.2(1) a + [ Fe 56 ] 9.94(3) a [ Fe 57 ] 2.3(1) a [ Fe 58 ] 15.(7) a + [ Co . ] 2.49(2) a [ Co 59 ] 2.49(2) a [ Ni . ] 10.3(1) a + [ Ni 58 ] 14.4(1) a [ Ni 60 ] 2.8(1) a [ Ni 61 ] 7.60(6) a + [ Ni 62 ] -8.7(2) a [ Ni 64 ] -0.37(7) a [ Cu . ] 7.718(4) a + [ Cu 63 ] 6.43(15) a [ Cu 65 ] 10.61(19) a [ Zn . ] 5.680(5) a + [ Zn 64 ] 5.22(4) a [ Zn 66 ] 5.97(5) a [ Zn 67 ] 7.56(8) a + [ Zn 68 ] 6.03(3) a [ Zn 70 ] 6.(1) a [ Ga . ] 7.288(2) a + [ Ga 69 ] 7.88(2) a [ Ga 71 ] 6.40(3) a [ Ge . ] 8.185(20) a + [ Ge 70 ] 10.0(1) a [ Ge 72 ] 8.51(10) a [ Ge 73 ] 5.02(4) a + [ Ge 74 ] 7.58(10) a [ Ge 76 ] 8.2(15) a [ As . ] 6.58(1) a + [ As 75 ] 6.58(1) a [ Se . ] 7.970(9) a [ Se 74 ] 0.8(30) a + [ Se 76 ] 12.2(1) a [ Se 77 ] 8.25(8) a [ Se 78 ] 8.24(9) a + [ Se 80 ] 7.48(3) a [ Se 82 ] 6.34(8) a [ Br . ] 6.795(15) a + [ Br 79 ] 6.8(7) a [ Br 81 ] 6.79(7) a [ Kr . ] 7.81(2) a + [ Kr 78 ] ? a [ Kr 80 ] ? a [ Kr 82 ] ? a + [ Kr 83 ] ? a [ Kr 84 ] ? a [ Kr 86 ] 8.1(2) a + [ Rb . ] 7.09(2) a [ Rb 85 ] 7.03(10) a [ Rb 87 ] 7.23(12) a + [ Sr . ] 7.02(2) a [ Sr 84 ] 7.(1) a [ Sr 86 ] 5.67(5) a + [ Sr 87 ] 7.40(7) a [ Sr 88 ] 7.15(6) a [ Y . ] 7.75(2) a + [ Y 89 ] 7.75(2) a [ Zr . ] 7.16(3) a [ Zr 90 ] 6.4(1) a + [ Zr 91 ] 8.7(1) a [ Zr 92 ] 7.4(2) a [ Zr 94 ] 8.2(2) a + [ Zr 96 ] 5.5(1) a [ Nb . ] 7.054(3) a [ Nb 93 ] 7.054(3) a + [ Mo . ] 6.715(20) a [ Mo 92 ] 6.91(8) a [ Mo 94 ] 6.80(7) a + [ Mo 95 ] 6.91(6) a [ Mo 96 ] 6.20(6) a [ Mo 97 ] 7.24(8) a + [ Mo 98 ] 6.58(7) a [ Mo 100 ] 6.73(7) a [ Tc . ] ? a + [ Tc 99 ] 6.8(3) a [ Ru . ] 7.03(3) a [ Ru 96 ] ? a + [ Ru 98 ] ? a [ Ru 99 ] ? a [ Ru 100 ] ? a + [ Ru 101 ] ? a [ Ru 102 ] ? a [ Ru 104 ] ? a + [ Rh . ] 5.88(4) a [ Rh 103 ] 5.88(4) a [ Pd . ] 5.91(6) a + [ Pd 102 ] 7.7(7) a [ Pd 104 ] 7.7(7) a [ Pd 105 ] 5.5(3) a + [ Pd 106 ] 6.4(4) a [ Pd 108 ] 4.1(3) a [ Pd 110 ] 7.7(7) a + [ Ag . ] 5.922(7) a [ Ag 107 ] 7.555(11) a [ Ag 109 ] 4.165(11) a + [ Cd . ] 4.87(5)-0.70(1)i a [ Cd 106 ] 5.(2) a [ Cd 108 ] 5.4(1) a + [ Cd 110 ] 5.9(1) a [ Cd 111 ] 6.5(1) a [ Cd 112 ] 6.4(1) a + [ Cd 113 ] -8.0(2)-5.73(11)i a [ Cd 114 ] 7.5(1) a [ Cd 116 ] 6.3(1) a + [ In . ] 4.065(20)-0.0539(4)i a [ In 113 ] 5.39(6) a [ In 115 ] 4.01(2)-0.0562(6)i a + [ Sn . ] 6.225(2) a [ Sn 112 ] 6.(1) a [ Sn 114 ] 6.2(3) a + [ Sn 115 ] 6.(1) a [ Sn 116 ] 5.93(5) a [ Sn 117 ] 6.48(5) a + [ Sn 118 ] 6.07(5) a [ Sn 119 ] 6.12(5) a [ Sn 120 ] 6.49(5) a + [ Sn 122 ] 5.74(5) a [ Sn 124 ] 5.97(5) a [ Sb . ] 5.57(3) a + [ Sb 121 ] 5.71(6) a [ Sb 123 ] 5.38(7) a [ Te . ] 5.80(3) a + [ Te 120 ] 5.3(5) a [ Te 122 ] 3.8(2) a [ Te 123 ] -0.05(25)-0.116(8)i a + [ Te 124 ] 7.96(10) a [ Te 125 ] 5.02(8) a [ Te 126 ] 5.56(7) a + [ Te 128 ] 5.89(7) a [ Te 130 ] 6.02(7) a [ I . ] 5.28(2) a + [ I 127 ] 5.28(2) a [ Xe . ] 4.92(3) a [ Xe 124 ] ? a + [ Xe 126 ] ? a [ Xe 128 ] ? a [ Xe 129 ] ? a + [ Xe 130 ] ? a [ Xe 131 ] ? a [ Xe 132 ] ? a + [ Xe 134 ] ? a [ Xe 136 ] ? a [ Cs . ] 5.42(2) a + [ Cs 133 ] 5.42(2) a [ Ba . ] 5.07(3) a [ Ba 130 ] -3.6(6) a + [ Ba 132 ] 7.8(3) a [ Ba 134 ] 5.7(1) a [ Ba 135 ] 4.67(10) a + [ Ba 136 ] 4.91(8) a [ Ba 137 ] 6.83(10) a [ Ba 138 ] 4.84(8) a + [ La . ] 8.24(4) a [ La 138 ] 8.(2) a [ La 139 ] 8.24(4) a + [ Ce . ] 4.84(2) a [ Ce 136 ] 5.80(9) a [ Ce 138 ] 6.70(9) a + [ Ce 140 ] 4.84(9) a [ Ce 142 ] 4.75(9) a [ Pr . ] 4.58(5) a + [ Pr 141 ] 4.58(5) a [ Nd . ] 7.69(5) a [ Nd 142 ] 7.7(3) a + [ Nd 143 ] 14.(2) a [ Nd 144 ] 2.8(3) a [ Nd 145 ] 14.(2) a + [ Nd 146 ] 8.7(2) a [ Nd 148 ] 5.7(3) a [ Nd 150 ] 5.3(2) a + [ Pm . ] ? a [ Pm 147 ] 12.6(4) a [ Sm . ] 0.80(2)-1.65(2)i a + [ Sm 144 ] -3.(4) a [ Sm 147 ] 14.(3) a [ Sm 148 ] -3.(4) a + [ Sm 149 ] -19.2(1)-11.7(1)i a [ Sm 150 ] 14.(3) a [ Sm 152 ] -5.00(6) a + [ Sm 154 ] 9.3(10) a [ Eu . ] 7.22(2)-1.26(1)i a [ Eu 151 ] 6.13(14)-2.53(3)i a + [ Eu 153 ] 8.22(12) a [ Gd . ] 6.5(5)-13.82(3)i a [ Gd 152 ] 10.(3) a + [ Gd 154 ] 10.(3) a [ Gd 155 ] 6.0(1)-17.0(1)i a [ Gd 156 ] 6.3(4) a + [ Gd 157 ] -1.14(2)-71.9(2)i a [ Gd 158 ] 9.(2) a [ Gd 160 ] 9.15(5) a + [ Tb . ] 7.38(3) a [ Tb 159 ] 7.38(3) a [ Dy . ] 16.9(2)-0.276(4)i a + [ Dy 156 ] 6.1(5) a [ Dy 158 ] 6.(4) a [ Dy 160 ] 6.7(4) a + [ Dy 161 ] 10.3(4) a [ Dy 162 ] -1.4(5) a [ Dy 163 ] 5.0(4) a + [ Dy 164 ] 49.4(2)-0.79(1)i a [ Ho . ] 8.01(8) a [ Ho 165 ] 8.01(8) a + [ Er . ] 7.79(2) a [ Er 162 ] 8.8(2) a [ Er 164 ] 8.2(2) a + [ Er 166 ] 10.6(2) a [ Er 167 ] 3.0(3) a [ Er 168 ] 7.4(4) a + [ Er 170 ] 9.6(5) a [ Tm . ] 7.07(3) a [ Tm 169 ] 7.07(3) a + [ Yb . ] 12.43(3) a [ Yb 168 ] -4.07(2)-0.62(1)i a [ Yb 170 ] 6.77(10) a + [ Yb 171 ] 9.66(10) a [ Yb 172 ] 9.43(10) a [ Yb 173 ] 9.56(7) a + [ Yb 174 ] 19.3(1) a [ Yb 176 ] 8.72(10) a [ Lu . ] 7.21(3) a + [ Lu 175 ] 7.24(3) a [ Lu 176 ] 6.1(1)-0.57(1)i a [ Hf . ] 7.7(14) a + [ Hf 174 ] 10.9(11) a [ Hf 176 ] 6.61(18) a [ Hf 177 ] 0.8(10) a + [ Hf 178 ] 5.9(2) a [ Hf 179 ] 7.46(16) a [ Hf 180 ] 13.2(3) a + [ Ta . ] 6.91(7) a [ Ta 180 ] 7.(2) a [ Ta 181 ] 6.91(7) a + [ W . ] 4.86(2) a [ W 180 ] 5.(3) a [ W 182 ] 6.97(4) a + [ W 183 ] 6.53(4) a [ W 184 ] 7.48(6) a [ W 186 ] -0.72(4) a + [ Re . ] 9.2(2) a [ Re 185 ] 9.0(3) a [ Re 187 ] 9.3(3) a + [ Os . ] 10.7(2) a [ Os 184 ] 10.(2) a [ Os 186 ] 11.6(17) a + [ Os 187 ] 10.(2) a [ Os 188 ] 7.6(3) a [ Os 189 ] 10.7(3) a + [ Os 190 ] 11.0(3) a [ Os 192 ] 11.5(4) a [ Ir . ] 10.6(3) a + [ Ir 191 ] ? a [ Ir 193 ] ? a [ Pt . ] 9.6(1) a + [ Pt 190 ] 9.0(10) a [ Pt 192 ] 9.9(5) a [ Pt 194 ] 10.55(8) a + [ Pt 195 ] 8.83(11) a [ Pt 196 ] 9.89(8) a [ Pt 198 ] 7.8(1) a + [ Au . ] 7.63(6) a [ Au 197 ] 7.63(6) a [ Hg . ] 12.692(15) a + [ Hg 196 ] 30.3(10) a [ Hg 198 ] ? a [ Hg 199 ] 16.9(4) a + [ Hg 200 ] ? a [ Hg 201 ] ? a [ Hg 202 ] ? a + [ Hg 204 ] ? a [ Tl . ] 8.776(5) a [ Tl 203 ] 6.99(16) a + [ Tl 205 ] 9.52(7) a [ Pb . ] 9.405(3) a [ Pb 204 ] 9.90(10) a + [ Pb 206 ] 9.22(5) a [ Pb 207 ] 9.28(4) a [ Pb 208 ] 9.50(2) a + [ Bi . ] 8.532(2) a [ Bi 209 ] 8.532(2) a [ Po . ] ? a + [ At . ] ? a [ Rn . ] ? a [ Fr . ] ? a + [ Ra . ] ? a [ Ra 226 ] 10.0(10) a [ Ac . ] ? a + [ Th . ] ? a [ Th 232 ] 10.31(3) a [ Pa . ] 9.1(3) a + [ Pa 231 ] 9.1(3) a [ U . ] 8.417(5) a [ U 233 ] 10.1(2) a + [ U 234 ] 12.4(3) a [ U 235 ] 10.47(4) a [ U 238 ] 8.402(5) a + [ Np . ] ? a [ Np 237 ] 10.55(10) a [ Pu . ] ? a + [ Pu 238 ] 14.1(5) a [ Pu 239 ] 7.7(1) a [ Pu 240 ] 3.5(1) a + [ Pu 242 ] 8.1(1) a [ Am . ] ? a [ Am 243 ] 8.3(2) a + [ Cm . ] ? a [ Cm 244 ] 9.5(3) a [ Cm 246 ] 9.3(2) a + [ Cm 248 ] 7.7(2) a save_ From 2663276216348051eab9b8067fdb4a71ebaaee39 Mon Sep 17 00:00:00 2001 From: Matthew Rowles Date: Sun, 19 Jul 2026 21:30:53 +0800 Subject: [PATCH 9/9] complex number is [+-]j. always. --- templ_enum.cif | 254 ++++++++++++++++++++++++------------------------- 1 file changed, 127 insertions(+), 127 deletions(-) diff --git a/templ_enum.cif b/templ_enum.cif index 01097ad..30a40b2 100644 --- a/templ_enum.cif +++ b/templ_enum.cif @@ -1163,140 +1163,140 @@ save_length_neutron _enumeration_defaults.index _enumeration_defaults.value _enumeration_defaults.source_id - [ H . ] -3.7390(11) a [ H 1 ] -3.7406(11) a [ H 2 ] 6.671(4) a - [ D . ] 6.671(4) a [ D 2 ] 6.671(4) a [ H 3 ] 4.792(27) a - [ He . ] 3.26(3) a [ He 3 ] 5.74(7)-1.483(2)i a [ He 4 ] 3.26(3) a - [ Li . ] -1.90(2) a [ Li 6 ] 2.00(11)-0.261(1)i a [ Li 7 ] -2.22(2) a - [ Be . ] 7.79(1) a [ Be 9 ] 7.79(1) a [ B . ] 5.30(4)-0.213(2)i a - [ B 10 ] -0.1(3)-1.066(3)i a [ B 11 ] 6.65(4) a [ C . ] 6.6460(12) a - [ C 12 ] 6.6511(16) a [ C 13 ] 6.19(9) a [ N . ] 9.36(2) a - [ N 14 ] 9.37(2) a [ N 15 ] 6.44(3) a [ O . ] 5.803(4) a - [ O 16 ] 5.803(4) a [ O 17 ] 5.78(15) a [ O 18 ] 5.84(7) a - [ F . ] 5.654(10) a [ F 19 ] 5.654(10) a [ Ne . ] 4.566(6) a - [ Ne 20 ] 4.631(6) a [ Ne 21 ] 6.66(19) a [ Ne 22 ] 3.87(1) a - [ Na . ] 3.63(2) a [ Na 23 ] 3.63(2) a [ Mg . ] 5.375(4) a - [ Mg 24 ] 5.66(3) a [ Mg 25 ] 3.62(14) a [ Mg 26 ] 4.89(15) a - [ Al . ] 3.449(5) a [ Al 27 ] 3.449(5) a [ Si . ] 4.1491(10) a - [ Si 28 ] 4.107(6) a [ Si 29 ] 4.7(10) a [ Si 30 ] 4.58(8) a - [ P . ] 5.13(1) a [ P 31 ] 5.13(1) a [ S . ] 2.847(1) a - [ S 32 ] 2.804(2) a [ S 33 ] 4.74(19) a [ S 34 ] 3.48(3) a - [ S 36 ] 3.(1) a [ Cl . ] 9.5770(8) a [ Cl 35 ] 11.65(2) a - [ Cl 37 ] 3.08(6) a [ Ar . ] 1.909(6) a [ Ar 36 ] 24.9(7) a - [ Ar 38 ] 3.5(35) a [ Ar 40 ] 1.83(6) a [ K . ] 3.67(2) a - [ K 39 ] 3.74(2) a [ K 40 ] 3.(1) a [ K 41 ] 2.69(8) a - [ Ca . ] 4.70(2) a [ Ca 40 ] 4.80(2) a [ Ca 42 ] 3.36(10) a - [ Ca 43 ] -1.56(9) a [ Ca 44 ] 1.42(6) a [ Ca 46 ] 3.6(2) a - [ Ca 48 ] 0.39(9) a [ Sc . ] 12.29(11) a [ Sc 45 ] 12.29(11) a - [ Ti . ] -3.370(13) b [ Ti 46 ] 4.725(5) b [ Ti 47 ] 3.53(7) b - [ Ti 48 ] -5.86(2) b [ Ti 49 ] 0.98(5) b [ Ti 50 ] 5.88(10) b - [ V . ] -0.3824(12) a [ V 50 ] 7.6(6) a [ V 51 ] -0.402(2) a - [ Cr . ] 3.635(7) a [ Cr 50 ] -4.5(5) a [ Cr 52 ] 4.920(10) a - [ Cr 53 ] -4.20(3) a [ Cr 54 ] 4.55(10) a [ Mn . ] -3.750(18) b - [ Mn 55 ] -3.750(18) b [ Fe . ] 9.45(2) a [ Fe 54 ] 4.2(1) a - [ Fe 56 ] 9.94(3) a [ Fe 57 ] 2.3(1) a [ Fe 58 ] 15.(7) a - [ Co . ] 2.49(2) a [ Co 59 ] 2.49(2) a [ Ni . ] 10.3(1) a - [ Ni 58 ] 14.4(1) a [ Ni 60 ] 2.8(1) a [ Ni 61 ] 7.60(6) a - [ Ni 62 ] -8.7(2) a [ Ni 64 ] -0.37(7) a [ Cu . ] 7.718(4) a - [ Cu 63 ] 6.43(15) a [ Cu 65 ] 10.61(19) a [ Zn . ] 5.680(5) a - [ Zn 64 ] 5.22(4) a [ Zn 66 ] 5.97(5) a [ Zn 67 ] 7.56(8) a - [ Zn 68 ] 6.03(3) a [ Zn 70 ] 6.(1) a [ Ga . ] 7.288(2) a - [ Ga 69 ] 7.88(2) a [ Ga 71 ] 6.40(3) a [ Ge . ] 8.185(20) a - [ Ge 70 ] 10.0(1) a [ Ge 72 ] 8.51(10) a [ Ge 73 ] 5.02(4) a - [ Ge 74 ] 7.58(10) a [ Ge 76 ] 8.2(15) a [ As . ] 6.58(1) a - [ As 75 ] 6.58(1) a [ Se . ] 7.970(9) a [ Se 74 ] 0.8(30) a - [ Se 76 ] 12.2(1) a [ Se 77 ] 8.25(8) a [ Se 78 ] 8.24(9) a - [ Se 80 ] 7.48(3) a [ Se 82 ] 6.34(8) a [ Br . ] 6.795(15) a - [ Br 79 ] 6.8(7) a [ Br 81 ] 6.79(7) a [ Kr . ] 7.81(2) a + [ H . ] -3.7390(11)+0j a [ H 1 ] -3.7406(11)+0j a [ H 2 ] 6.671(4)+0j a + [ D . ] 6.671(4)+0j a [ D 2 ] 6.671(4)+0j a [ H 3 ] 4.792(27)+0j a + [ He . ] 3.26(3)+0j a [ He 3 ] 5.74(7)-1.483(2)j a [ He 4 ] 3.26(3)+0j a + [ Li . ] -1.90(2)+0j a [ Li 6 ] 2.00(11)-0.261(1)j a [ Li 7 ] -2.22(2)+0j a + [ Be . ] 7.79(1)+0j a [ Be 9 ] 7.79(1)+0j a [ B . ] 5.30(4)-0.213(2)j a + [ B 10 ] -0.1(3)-1.066(3)j a [ B 11 ] 6.65(4)+0j a [ C . ] 6.6460(12)+0j a + [ C 12 ] 6.6511(16)+0j a [ C 13 ] 6.19(9)+0j a [ N . ] 9.36(2)+0j a + [ N 14 ] 9.37(2)+0j a [ N 15 ] 6.44(3)+0j a [ O . ] 5.803(4)+0j a + [ O 16 ] 5.803(4)+0j a [ O 17 ] 5.78(15)+0j a [ O 18 ] 5.84(7)+0j a + [ F . ] 5.654(10)+0j a [ F 19 ] 5.654(10)+0j a [ Ne . ] 4.566(6)+0j a + [ Ne 20 ] 4.631(6)+0j a [ Ne 21 ] 6.66(19)+0j a [ Ne 22 ] 3.87(1)+0j a + [ Na . ] 3.63(2)+0j a [ Na 23 ] 3.63(2)+0j a [ Mg . ] 5.375(4)+0j a + [ Mg 24 ] 5.66(3)+0j a [ Mg 25 ] 3.62(14)+0j a [ Mg 26 ] 4.89(15)+0j a + [ Al . ] 3.449(5)+0j a [ Al 27 ] 3.449(5)+0j a [ Si . ] 4.1491(10)+0j a + [ Si 28 ] 4.107(6)+0j a [ Si 29 ] 4.7(10)+0j a [ Si 30 ] 4.58(8)+0j a + [ P . ] 5.13(1)+0j a [ P 31 ] 5.13(1)+0j a [ S . ] 2.847(1)+0j a + [ S 32 ] 2.804(2)+0j a [ S 33 ] 4.74(19)+0j a [ S 34 ] 3.48(3)+0j a + [ S 36 ] 3.(1)+0j a [ Cl . ] 9.5770(8)+0j a [ Cl 35 ] 11.65(2)+0j a + [ Cl 37 ] 3.08(6)+0j a [ Ar . ] 1.909(6)+0j a [ Ar 36 ] 24.9(7)+0j a + [ Ar 38 ] 3.5(35)+0j a [ Ar 40 ] 1.83(6)+0j a [ K . ] 3.67(2)+0j a + [ K 39 ] 3.74(2)+0j a [ K 40 ] 3.(1)+0j a [ K 41 ] 2.69(8)+0j a + [ Ca . ] 4.70(2)+0j a [ Ca 40 ] 4.80(2)+0j a [ Ca 42 ] 3.36(10)+0j a + [ Ca 43 ] -1.56(9)+0j a [ Ca 44 ] 1.42(6)+0j a [ Ca 46 ] 3.6(2)+0j a + [ Ca 48 ] 0.39(9)+0j a [ Sc . ] 12.29(11)+0j a [ Sc 45 ] 12.29(11)+0j a + [ Ti . ] -3.370(13)+0j b [ Ti 46 ] 4.725(5)+0j b [ Ti 47 ] 3.53(7)+0j b + [ Ti 48 ] -5.86(2)+0j b [ Ti 49 ] 0.98(5)+0j b [ Ti 50 ] 5.88(10)+0j b + [ V . ] -0.3824(12)+0j a [ V 50 ] 7.6(6)+0j a [ V 51 ] -0.402(2)+0j a + [ Cr . ] 3.635(7)+0j a [ Cr 50 ] -4.5(5)+0j a [ Cr 52 ] 4.920(10)+0j a + [ Cr 53 ] -4.20(3)+0j a [ Cr 54 ] 4.55(10)+0j a [ Mn . ] -3.750(18)+0j b + [ Mn 55 ] -3.750(18)+0j b [ Fe . ] 9.45(2)+0j a [ Fe 54 ] 4.2(1)+0j a + [ Fe 56 ] 9.94(3)+0j a [ Fe 57 ] 2.3(1)+0j a [ Fe 58 ] 15.(7)+0j a + [ Co . ] 2.49(2)+0j a [ Co 59 ] 2.49(2)+0j a [ Ni . ] 10.3(1)+0j a + [ Ni 58 ] 14.4(1)+0j a [ Ni 60 ] 2.8(1)+0j a [ Ni 61 ] 7.60(6)+0j a + [ Ni 62 ] -8.7(2)+0j a [ Ni 64 ] -0.37(7)+0j a [ Cu . ] 7.718(4)+0j a + [ Cu 63 ] 6.43(15)+0j a [ Cu 65 ] 10.61(19)+0j a [ Zn . ] 5.680(5)+0j a + [ Zn 64 ] 5.22(4)+0j a [ Zn 66 ] 5.97(5)+0j a [ Zn 67 ] 7.56(8)+0j a + [ Zn 68 ] 6.03(3)+0j a [ Zn 70 ] 6.(1)+0j a [ Ga . ] 7.288(2)+0j a + [ Ga 69 ] 7.88(2)+0j a [ Ga 71 ] 6.40(3)+0j a [ Ge . ] 8.185(20)+0j a + [ Ge 70 ] 10.0(1)+0j a [ Ge 72 ] 8.51(10)+0j a [ Ge 73 ] 5.02(4)+0j a + [ Ge 74 ] 7.58(10)+0j a [ Ge 76 ] 8.2(15)+0j a [ As . ] 6.58(1)+0j a + [ As 75 ] 6.58(1)+0j a [ Se . ] 7.970(9)+0j a [ Se 74 ] 0.8(30)+0j a + [ Se 76 ] 12.2(1)+0j a [ Se 77 ] 8.25(8)+0j a [ Se 78 ] 8.24(9)+0j a + [ Se 80 ] 7.48(3)+0j a [ Se 82 ] 6.34(8)+0j a [ Br . ] 6.795(15)+0j a + [ Br 79 ] 6.8(7)+0j a [ Br 81 ] 6.79(7)+0j a [ Kr . ] 7.81(2)+0j a [ Kr 78 ] ? a [ Kr 80 ] ? a [ Kr 82 ] ? a - [ Kr 83 ] ? a [ Kr 84 ] ? a [ Kr 86 ] 8.1(2) a - [ Rb . ] 7.09(2) a [ Rb 85 ] 7.03(10) a [ Rb 87 ] 7.23(12) a - [ Sr . ] 7.02(2) a [ Sr 84 ] 7.(1) a [ Sr 86 ] 5.67(5) a - [ Sr 87 ] 7.40(7) a [ Sr 88 ] 7.15(6) a [ Y . ] 7.75(2) a - [ Y 89 ] 7.75(2) a [ Zr . ] 7.16(3) a [ Zr 90 ] 6.4(1) a - [ Zr 91 ] 8.7(1) a [ Zr 92 ] 7.4(2) a [ Zr 94 ] 8.2(2) a - [ Zr 96 ] 5.5(1) a [ Nb . ] 7.054(3) a [ Nb 93 ] 7.054(3) a - [ Mo . ] 6.715(20) a [ Mo 92 ] 6.91(8) a [ Mo 94 ] 6.80(7) a - [ Mo 95 ] 6.91(6) a [ Mo 96 ] 6.20(6) a [ Mo 97 ] 7.24(8) a - [ Mo 98 ] 6.58(7) a [ Mo 100 ] 6.73(7) a [ Tc . ] ? a - [ Tc 99 ] 6.8(3) a [ Ru . ] 7.03(3) a [ Ru 96 ] ? a + [ Kr 83 ] ? a [ Kr 84 ] ? a [ Kr 86 ] 8.1(2)+0j a + [ Rb . ] 7.09(2)+0j a [ Rb 85 ] 7.03(10)+0j a [ Rb 87 ] 7.23(12)+0j a + [ Sr . ] 7.02(2)+0j a [ Sr 84 ] 7.(1)+0j a [ Sr 86 ] 5.67(5)+0j a + [ Sr 87 ] 7.40(7)+0j a [ Sr 88 ] 7.15(6)+0j a [ Y . ] 7.75(2)+0j a + [ Y 89 ] 7.75(2)+0j a [ Zr . ] 7.16(3)+0j a [ Zr 90 ] 6.4(1)+0j a + [ Zr 91 ] 8.7(1)+0j a [ Zr 92 ] 7.4(2)+0j a [ Zr 94 ] 8.2(2)+0j a + [ Zr 96 ] 5.5(1)+0j a [ Nb . ] 7.054(3)+0j a [ Nb 93 ] 7.054(3)+0j a + [ Mo . ] 6.715(20)+0j a [ Mo 92 ] 6.91(8)+0j a [ Mo 94 ] 6.80(7)+0j a + [ Mo 95 ] 6.91(6)+0j a [ Mo 96 ] 6.20(6)+0j a [ Mo 97 ] 7.24(8)+0j a + [ Mo 98 ] 6.58(7)+0j a [ Mo 100 ] 6.73(7)+0j a [ Tc . ] ? a + [ Tc 99 ] 6.8(3)+0j a [ Ru . ] 7.03(3)+0j a [ Ru 96 ] ? a [ Ru 98 ] ? a [ Ru 99 ] ? a [ Ru 100 ] ? a [ Ru 101 ] ? a [ Ru 102 ] ? a [ Ru 104 ] ? a - [ Rh . ] 5.88(4) a [ Rh 103 ] 5.88(4) a [ Pd . ] 5.91(6) a - [ Pd 102 ] 7.7(7) a [ Pd 104 ] 7.7(7) a [ Pd 105 ] 5.5(3) a - [ Pd 106 ] 6.4(4) a [ Pd 108 ] 4.1(3) a [ Pd 110 ] 7.7(7) a - [ Ag . ] 5.922(7) a [ Ag 107 ] 7.555(11) a [ Ag 109 ] 4.165(11) a - [ Cd . ] 4.87(5)-0.70(1)i a [ Cd 106 ] 5.(2) a [ Cd 108 ] 5.4(1) a - [ Cd 110 ] 5.9(1) a [ Cd 111 ] 6.5(1) a [ Cd 112 ] 6.4(1) a - [ Cd 113 ] -8.0(2)-5.73(11)i a [ Cd 114 ] 7.5(1) a [ Cd 116 ] 6.3(1) a - [ In . ] 4.065(20)-0.0539(4)i a [ In 113 ] 5.39(6) a [ In 115 ] 4.01(2)-0.0562(6)i a - [ Sn . ] 6.225(2) a [ Sn 112 ] 6.(1) a [ Sn 114 ] 6.2(3) a - [ Sn 115 ] 6.(1) a [ Sn 116 ] 5.93(5) a [ Sn 117 ] 6.48(5) a - [ Sn 118 ] 6.07(5) a [ Sn 119 ] 6.12(5) a [ Sn 120 ] 6.49(5) a - [ Sn 122 ] 5.74(5) a [ Sn 124 ] 5.97(5) a [ Sb . ] 5.57(3) a - [ Sb 121 ] 5.71(6) a [ Sb 123 ] 5.38(7) a [ Te . ] 5.80(3) a - [ Te 120 ] 5.3(5) a [ Te 122 ] 3.8(2) a [ Te 123 ] -0.05(25)-0.116(8)i a - [ Te 124 ] 7.96(10) a [ Te 125 ] 5.02(8) a [ Te 126 ] 5.56(7) a - [ Te 128 ] 5.89(7) a [ Te 130 ] 6.02(7) a [ I . ] 5.28(2) a - [ I 127 ] 5.28(2) a [ Xe . ] 4.92(3) a [ Xe 124 ] ? a + [ Rh . ] 5.88(4)+0j a [ Rh 103 ] 5.88(4)+0j a [ Pd . ] 5.91(6)+0j a + [ Pd 102 ] 7.7(7)+0j a [ Pd 104 ] 7.7(7)+0j a [ Pd 105 ] 5.5(3)+0j a + [ Pd 106 ] 6.4(4)+0j a [ Pd 108 ] 4.1(3)+0j a [ Pd 110 ] 7.7(7)+0j a + [ Ag . ] 5.922(7)+0j a [ Ag 107 ] 7.555(11)+0j a [ Ag 109 ] 4.165(11)+0j a + [ Cd . ] 4.87(5)-0.70(1)j a [ Cd 106 ] 5.(2)+0j a [ Cd 108 ] 5.4(1)+0j a + [ Cd 110 ] 5.9(1)+0j a [ Cd 111 ] 6.5(1)+0j a [ Cd 112 ] 6.4(1)+0j a + [ Cd 113 ] -8.0(2)-5.73(11)j a [ Cd 114 ] 7.5(1)+0j a [ Cd 116 ] 6.3(1)+0j a + [ In . ] 4.065(20)-0.0539(4)j a [ In 113 ] 5.39(6)+0j a [ In 115 ] 4.01(2)-0.0562(6)j a + [ Sn . ] 6.225(2)+0j a [ Sn 112 ] 6.(1)+0j a [ Sn 114 ] 6.2(3)+0j a + [ Sn 115 ] 6.(1)+0j a [ Sn 116 ] 5.93(5)+0j a [ Sn 117 ] 6.48(5)+0j a + [ Sn 118 ] 6.07(5)+0j a [ Sn 119 ] 6.12(5)+0j a [ Sn 120 ] 6.49(5)+0j a + [ Sn 122 ] 5.74(5)+0j a [ Sn 124 ] 5.97(5)+0j a [ Sb . ] 5.57(3)+0j a + [ Sb 121 ] 5.71(6)+0j a [ Sb 123 ] 5.38(7)+0j a [ Te . ] 5.80(3)+0j a + [ Te 120 ] 5.3(5)+0j a [ Te 122 ] 3.8(2)+0j a [ Te 123 ] -0.05(25)-0.116(8)j a + [ Te 124 ] 7.96(10)+0j a [ Te 125 ] 5.02(8)+0j a [ Te 126 ] 5.56(7)+0j a + [ Te 128 ] 5.89(7)+0j a [ Te 130 ] 6.02(7)+0j a [ I . ] 5.28(2)+0j a + [ I 127 ] 5.28(2)+0j a [ Xe . ] 4.92(3)+0j a [ Xe 124 ] ? a [ Xe 126 ] ? a [ Xe 128 ] ? a [ Xe 129 ] ? a [ Xe 130 ] ? a [ Xe 131 ] ? a [ Xe 132 ] ? a - [ Xe 134 ] ? a [ Xe 136 ] ? a [ Cs . ] 5.42(2) a - [ Cs 133 ] 5.42(2) a [ Ba . ] 5.07(3) a [ Ba 130 ] -3.6(6) a - [ Ba 132 ] 7.8(3) a [ Ba 134 ] 5.7(1) a [ Ba 135 ] 4.67(10) a - [ Ba 136 ] 4.91(8) a [ Ba 137 ] 6.83(10) a [ Ba 138 ] 4.84(8) a - [ La . ] 8.24(4) a [ La 138 ] 8.(2) a [ La 139 ] 8.24(4) a - [ Ce . ] 4.84(2) a [ Ce 136 ] 5.80(9) a [ Ce 138 ] 6.70(9) a - [ Ce 140 ] 4.84(9) a [ Ce 142 ] 4.75(9) a [ Pr . ] 4.58(5) a - [ Pr 141 ] 4.58(5) a [ Nd . ] 7.69(5) a [ Nd 142 ] 7.7(3) a - [ Nd 143 ] 14.(2) a [ Nd 144 ] 2.8(3) a [ Nd 145 ] 14.(2) a - [ Nd 146 ] 8.7(2) a [ Nd 148 ] 5.7(3) a [ Nd 150 ] 5.3(2) a - [ Pm . ] ? a [ Pm 147 ] 12.6(4) a [ Sm . ] 0.80(2)-1.65(2)i a - [ Sm 144 ] -3.(4) a [ Sm 147 ] 14.(3) a [ Sm 148 ] -3.(4) a - [ Sm 149 ] -19.2(1)-11.7(1)i a [ Sm 150 ] 14.(3) a [ Sm 152 ] -5.00(6) a - [ Sm 154 ] 9.3(10) a [ Eu . ] 7.22(2)-1.26(1)i a [ Eu 151 ] 6.13(14)-2.53(3)i a - [ Eu 153 ] 8.22(12) a [ Gd . ] 6.5(5)-13.82(3)i a [ Gd 152 ] 10.(3) a - [ Gd 154 ] 10.(3) a [ Gd 155 ] 6.0(1)-17.0(1)i a [ Gd 156 ] 6.3(4) a - [ Gd 157 ] -1.14(2)-71.9(2)i a [ Gd 158 ] 9.(2) a [ Gd 160 ] 9.15(5) a - [ Tb . ] 7.38(3) a [ Tb 159 ] 7.38(3) a [ Dy . ] 16.9(2)-0.276(4)i a - [ Dy 156 ] 6.1(5) a [ Dy 158 ] 6.(4) a [ Dy 160 ] 6.7(4) a - [ Dy 161 ] 10.3(4) a [ Dy 162 ] -1.4(5) a [ Dy 163 ] 5.0(4) a - [ Dy 164 ] 49.4(2)-0.79(1)i a [ Ho . ] 8.01(8) a [ Ho 165 ] 8.01(8) a - [ Er . ] 7.79(2) a [ Er 162 ] 8.8(2) a [ Er 164 ] 8.2(2) a - [ Er 166 ] 10.6(2) a [ Er 167 ] 3.0(3) a [ Er 168 ] 7.4(4) a - [ Er 170 ] 9.6(5) a [ Tm . ] 7.07(3) a [ Tm 169 ] 7.07(3) a - [ Yb . ] 12.43(3) a [ Yb 168 ] -4.07(2)-0.62(1)i a [ Yb 170 ] 6.77(10) a - [ Yb 171 ] 9.66(10) a [ Yb 172 ] 9.43(10) a [ Yb 173 ] 9.56(7) a - [ Yb 174 ] 19.3(1) a [ Yb 176 ] 8.72(10) a [ Lu . ] 7.21(3) a - [ Lu 175 ] 7.24(3) a [ Lu 176 ] 6.1(1)-0.57(1)i a [ Hf . ] 7.7(14) a - [ Hf 174 ] 10.9(11) a [ Hf 176 ] 6.61(18) a [ Hf 177 ] 0.8(10) a - [ Hf 178 ] 5.9(2) a [ Hf 179 ] 7.46(16) a [ Hf 180 ] 13.2(3) a - [ Ta . ] 6.91(7) a [ Ta 180 ] 7.(2) a [ Ta 181 ] 6.91(7) a - [ W . ] 4.86(2) a [ W 180 ] 5.(3) a [ W 182 ] 6.97(4) a - [ W 183 ] 6.53(4) a [ W 184 ] 7.48(6) a [ W 186 ] -0.72(4) a - [ Re . ] 9.2(2) a [ Re 185 ] 9.0(3) a [ Re 187 ] 9.3(3) a - [ Os . ] 10.7(2) a [ Os 184 ] 10.(2) a [ Os 186 ] 11.6(17) a - [ Os 187 ] 10.(2) a [ Os 188 ] 7.6(3) a [ Os 189 ] 10.7(3) a - [ Os 190 ] 11.0(3) a [ Os 192 ] 11.5(4) a [ Ir . ] 10.6(3) a - [ Ir 191 ] ? a [ Ir 193 ] ? a [ Pt . ] 9.6(1) a - [ Pt 190 ] 9.0(10) a [ Pt 192 ] 9.9(5) a [ Pt 194 ] 10.55(8) a - [ Pt 195 ] 8.83(11) a [ Pt 196 ] 9.89(8) a [ Pt 198 ] 7.8(1) a - [ Au . ] 7.63(6) a [ Au 197 ] 7.63(6) a [ Hg . ] 12.692(15) a - [ Hg 196 ] 30.3(10) a [ Hg 198 ] ? a [ Hg 199 ] 16.9(4) a + [ Xe 134 ] ? a [ Xe 136 ] ? a [ Cs . ] 5.42(2)+0j a + [ Cs 133 ] 5.42(2)+0j a [ Ba . ] 5.07(3)+0j a [ Ba 130 ] -3.6(6)+0j a + [ Ba 132 ] 7.8(3)+0j a [ Ba 134 ] 5.7(1)+0j a [ Ba 135 ] 4.67(10)+0j a + [ Ba 136 ] 4.91(8)+0j a [ Ba 137 ] 6.83(10)+0j a [ Ba 138 ] 4.84(8)+0j a + [ La . ] 8.24(4)+0j a [ La 138 ] 8.(2)+0j a [ La 139 ] 8.24(4)+0j a + [ Ce . ] 4.84(2)+0j a [ Ce 136 ] 5.80(9)+0j a [ Ce 138 ] 6.70(9)+0j a + [ Ce 140 ] 4.84(9)+0j a [ Ce 142 ] 4.75(9)+0j a [ Pr . ] 4.58(5)+0j a + [ Pr 141 ] 4.58(5)+0j a [ Nd . ] 7.69(5)+0j a [ Nd 142 ] 7.7(3)+0j a + [ Nd 143 ] 14.(2)+0j a [ Nd 144 ] 2.8(3)+0j a [ Nd 145 ] 14.(2)+0j a + [ Nd 146 ] 8.7(2)+0j a [ Nd 148 ] 5.7(3)+0j a [ Nd 150 ] 5.3(2)+0j a + [ Pm . ] ? a [ Pm 147 ] 12.6(4)+0j a [ Sm . ] 0.80(2)-1.65(2)j a + [ Sm 144 ] -3.(4)+0j a [ Sm 147 ] 14.(3)+0j a [ Sm 148 ] -3.(4)+0j a + [ Sm 149 ] -19.2(1)-11.7(1)j a [ Sm 150 ] 14.(3)+0j a [ Sm 152 ] -5.00(6)+0j a + [ Sm 154 ] 9.3(10)+0j a [ Eu . ] 7.22(2)-1.26(1)j a [ Eu 151 ] 6.13(14)-2.53(3)j a + [ Eu 153 ] 8.22(12)+0j a [ Gd . ] 6.5(5)-13.82(3)j a [ Gd 152 ] 10.(3)+0j a + [ Gd 154 ] 10.(3)+0j a [ Gd 155 ] 6.0(1)-17.0(1)j a [ Gd 156 ] 6.3(4)+0j a + [ Gd 157 ] -1.14(2)-71.9(2)j a [ Gd 158 ] 9.(2)+0j a [ Gd 160 ] 9.15(5)+0j a + [ Tb . ] 7.38(3)+0j a [ Tb 159 ] 7.38(3)+0j a [ Dy . ] 16.9(2)-0.276(4)j a + [ Dy 156 ] 6.1(5)+0j a [ Dy 158 ] 6.(4)+0j a [ Dy 160 ] 6.7(4)+0j a + [ Dy 161 ] 10.3(4)+0j a [ Dy 162 ] -1.4(5)+0j a [ Dy 163 ] 5.0(4)+0j a + [ Dy 164 ] 49.4(2)-0.79(1)j a [ Ho . ] 8.01(8)+0j a [ Ho 165 ] 8.01(8)+0j a + [ Er . ] 7.79(2)+0j a [ Er 162 ] 8.8(2)+0j a [ Er 164 ] 8.2(2)+0j a + [ Er 166 ] 10.6(2)+0j a [ Er 167 ] 3.0(3)+0j a [ Er 168 ] 7.4(4)+0j a + [ Er 170 ] 9.6(5)+0j a [ Tm . ] 7.07(3)+0j a [ Tm 169 ] 7.07(3)+0j a + [ Yb . ] 12.43(3)+0j a [ Yb 168 ] -4.07(2)-0.62(1)j a [ Yb 170 ] 6.77(10)+0j a + [ Yb 171 ] 9.66(10)+0j a [ Yb 172 ] 9.43(10)+0j a [ Yb 173 ] 9.56(7)+0j a + [ Yb 174 ] 19.3(1)+0j a [ Yb 176 ] 8.72(10)+0j a [ Lu . ] 7.21(3)+0j a + [ Lu 175 ] 7.24(3)+0j a [ Lu 176 ] 6.1(1)-0.57(1)j a [ Hf . ] 7.7(14)+0j a + [ Hf 174 ] 10.9(11)+0j a [ Hf 176 ] 6.61(18)+0j a [ Hf 177 ] 0.8(10)+0j a + [ Hf 178 ] 5.9(2)+0j a [ Hf 179 ] 7.46(16)+0j a [ Hf 180 ] 13.2(3)+0j a + [ Ta . ] 6.91(7)+0j a [ Ta 180 ] 7.(2)+0j a [ Ta 181 ] 6.91(7)+0j a + [ W . ] 4.86(2)+0j a [ W 180 ] 5.(3)+0j a [ W 182 ] 6.97(4)+0j a + [ W 183 ] 6.53(4)+0j a [ W 184 ] 7.48(6)+0j a [ W 186 ] -0.72(4)+0j a + [ Re . ] 9.2(2)+0j a [ Re 185 ] 9.0(3)+0j a [ Re 187 ] 9.3(3)+0j a + [ Os . ] 10.7(2)+0j a [ Os 184 ] 10.(2)+0j a [ Os 186 ] 11.6(17)+0j a + [ Os 187 ] 10.(2)+0j a [ Os 188 ] 7.6(3)+0j a [ Os 189 ] 10.7(3)+0j a + [ Os 190 ] 11.0(3)+0j a [ Os 192 ] 11.5(4)+0j a [ Ir . ] 10.6(3)+0j a + [ Ir 191 ] ? a [ Ir 193 ] ? a [ Pt . ] 9.6(1)+0j a + [ Pt 190 ] 9.0(10)+0j a [ Pt 192 ] 9.9(5)+0j a [ Pt 194 ] 10.55(8)+0j a + [ Pt 195 ] 8.83(11)+0j a [ Pt 196 ] 9.89(8)+0j a [ Pt 198 ] 7.8(1)+0j a + [ Au . ] 7.63(6)+0j a [ Au 197 ] 7.63(6)+0j a [ Hg . ] 12.692(15)+0j a + [ Hg 196 ] 30.3(10)+0j a [ Hg 198 ] ? a [ Hg 199 ] 16.9(4)+0j a [ Hg 200 ] ? a [ Hg 201 ] ? a [ Hg 202 ] ? a - [ Hg 204 ] ? a [ Tl . ] 8.776(5) a [ Tl 203 ] 6.99(16) a - [ Tl 205 ] 9.52(7) a [ Pb . ] 9.405(3) a [ Pb 204 ] 9.90(10) a - [ Pb 206 ] 9.22(5) a [ Pb 207 ] 9.28(4) a [ Pb 208 ] 9.50(2) a - [ Bi . ] 8.532(2) a [ Bi 209 ] 8.532(2) a [ Po . ] ? a + [ Hg 204 ] ? a [ Tl . ] 8.776(5)+0j a [ Tl 203 ] 6.99(16)+0j a + [ Tl 205 ] 9.52(7)+0j a [ Pb . ] 9.405(3)+0j a [ Pb 204 ] 9.90(10)+0j a + [ Pb 206 ] 9.22(5)+0j a [ Pb 207 ] 9.28(4)+0j a [ Pb 208 ] 9.50(2)+0j a + [ Bi . ] 8.532(2)+0j a [ Bi 209 ] 8.532(2)+0j a [ Po . ] ? a [ At . ] ? a [ Rn . ] ? a [ Fr . ] ? a - [ Ra . ] ? a [ Ra 226 ] 10.0(10) a [ Ac . ] ? a - [ Th . ] ? a [ Th 232 ] 10.31(3) a [ Pa . ] 9.1(3) a - [ Pa 231 ] 9.1(3) a [ U . ] 8.417(5) a [ U 233 ] 10.1(2) a - [ U 234 ] 12.4(3) a [ U 235 ] 10.47(4) a [ U 238 ] 8.402(5) a - [ Np . ] ? a [ Np 237 ] 10.55(10) a [ Pu . ] ? a - [ Pu 238 ] 14.1(5) a [ Pu 239 ] 7.7(1) a [ Pu 240 ] 3.5(1) a - [ Pu 242 ] 8.1(1) a [ Am . ] ? a [ Am 243 ] 8.3(2) a - [ Cm . ] ? a [ Cm 244 ] 9.5(3) a [ Cm 246 ] 9.3(2) a - [ Cm 248 ] 7.7(2) a + [ Ra . ] ? a [ Ra 226 ] 10.0(10)+0j a [ Ac . ] ? a + [ Th . ] ? a [ Th 232 ] 10.31(3)+0j a [ Pa . ] 9.1(3)+0j a + [ Pa 231 ] 9.1(3)+0j a [ U . ] 8.417(5)+0j a [ U 233 ] 10.1(2)+0j a + [ U 234 ] 12.4(3)+0j a [ U 235 ] 10.47(4)+0j a [ U 238 ] 8.402(5)+0j a + [ Np . ] ? a [ Np 237 ] 10.55(10)+0j a [ Pu . ] ? a + [ Pu 238 ] 14.1(5)+0j a [ Pu 239 ] 7.7(1)+0j a [ Pu 240 ] 3.5(1)+0j a + [ Pu 242 ] 8.1(1)+0j a [ Am . ] ? a [ Am 243 ] 8.3(2)+0j a + [ Cm . ] ? a [ Cm 244 ] 9.5(3)+0j a [ Cm 246 ] 9.3(2)+0j a + [ Cm 248 ] 7.7(2)+0j a save_