Crystallographic Information Framework

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Core dictionary version 3.0.14

_atom_type_scat.Cromer_Mann_b2

Name:
_atom_type_scat.Cromer_Mann_b2

Aliases:

_atom_type_scat_Cromer_Mann_b2
_atom_type.scat_Cromer_Mann_b2

Definition:

   
     The set of data items used to define Cromer-Mann coefficients
     for generation of X-ray scattering factors.

    Ref: International Tables for X-ray Crystallography, Vol. IV
         (1974) Table 2.2B
    or   International Tables for Crystallography, Vol. C
         (1991) Tables 6.1.1.4 and 6.1.1.5

Type: Real

Units: none

The following values are associated with the corresponding identifier (_atom_type.symbol):

H  26.1257 D  26.1257 H1-  15.187 He  3.3568 Li  1.0524 Li1+  1.9557 Be  1.8623 Be2+  .8313 B  1.021 C  10.2075 N  9.8933 O  5.7011 O1-  4.17236 F  4.2944 F1-  14.7353 Ne  3.4262 Na  8.8422 Na1+  6.1153 Mg  79.2611 Mg2+  4.7542 Al  .7426 Al3+  4.14553 Si  32.3337 Si4+  3.43757 P  27.157 S  22.2151 Cl  1.1662 Cl1-  1.1717 Ar  14.8407 K  .7748 K1+  .7674 Ca  .6599 Ca2+  .6089 Sc  .5729 Sc3+  7.9629 Ti  .5 Ti2+  .457585 Ti3+  7.04716 Ti4+  6.67018 V  .4385 V2+  .4409 V3+  .383349 V5+  5.40135 Cr  .392 Cr2+  .344261 Cr3+  .334393 Mn  .3432 Mn2+  .3435 Mn3+  .294393 Mn4+  .283303 Fe  .3072 Fe2+  .3053 Fe3+  .3005 Co  .2784 Co2+  .2726 Co3+  .238668 Ni  .2565 Ni2+  .2449 Ni3+  .22314 Cu  .247 Cu1+  .2274 Cu2+  .244078 Zn  .2333 Zn2+  .2031 Ga  .2412 Ga3+  .22789 Ge  .2516 Ge4+  .205855 As  .2647 Se  .2726 Br  16.5796 Br1-  19.3345 Kr  16.5623 Rb  17.3151 Rb1+  14.7957 Sr  14.0988 Sr2+  12.6963 Y  12.8006 Y3+  11.2145 Zr  11.916 Zr4+  10.1483 Nb  11.766 Nb3+  1.13305 Nb5+  .028781 Mo  1.0958 Mo3+  1.03031 Mo5+  1.02238 Mo6+  8.48061 Tc  8.14487 Ru  8.43467 Ru3+  8.37164 Ru4+  8.12534 Rh  8.21758 Rh3+  7.84438 Rh4+  7.62436 Pd  7.98929 Pd2+  7.55573 Pd4+  7.14833 Ag  7.4726 Ag1+  7.19123 Ag2+  7.18544 Cd  6.9089 Cd2+  6.80639 In  6.3776 In3+  6.3247 Sn  .5031 Sn2+  5.8378 Sn4+  .4655 Sb  .4607 Sb3+  5.22126 Sb5+  .467973 Te  .420885 I  .3814 I1-  .3815 Xe  0.344 Cs  .3107 Cs1+  .3086 Ba  .2756 Ba2+  .28331 La  .244475 La3+  .250698 Ce  .226836 Ce3+  .23154 Ce4+  .21885 Pr  .222087 Pr3+  .214299 Pr4+  .202481 Nd  .210628 Nd3+  .199237 Pm  0.202088 Sm  .196451 Sm3+  .174081 Eu  .1942 Eu2+  .17353 Eu3+  .16394 Gd  .181951 Gd3+  .155525 Tb  .196143 Tb3+  .149525 Dy  .202172 Dy3+  .143384 Ho  .19794 Ho3+  .139358 Er  .223545 Er3+  .13729 Tm  .238849 Tm3+  .136974 Yb  .25711 Yb2+  .15997 Yb3+  .13879 Lu  9.98519 Lu3+  .142292 Hf  9.5999 Hf4+  .128903 Ta  9.37046 Ta5+  .116741 W  9.2259 W6+  .104621 Re  9.09227 Os  8.97948 Os4+  6.84706 Ir  8.86553 Ir3+  7.10909 Ir4+  6.71983 Pt  8.81174 Pt2+  7.38979 Pt4+  6.60834 Au  8.6216 Au1+  7.7395 Au3+  6.82872 Hg  8.4484 Hg1+  7.65105 Hg2+  7.05639 Tl  8.70751 TL1+  .517394 Tl3+  6.53852 Pb  2.3576 Pb2+  .488383 Pb4+  6.10926 Bi  2.9238 Bi3+  6.24149 Bi5+  .039042 Po  3.55078 At  3.97458 Rn  4.0691 Fr  4.17619 Ra  3.87135 Ra2+  3.57670 Ac  3.65155 Ac3+  3.41437 Th  3.46204 Th4+  3.24498 Pa  3.41519 U  3.3253 U3+  3.12293 U4+  3.05053 U6+  2.89030 Np  3.25396 Np3+  3.03807 Np4+  2.96627 Np6+  2.81099 Pu  3.26371 Pu3+  2.96118 Pu4+  2.89020 Pu6+  2.73848 Am  3.20647 Cm  3.08997 Bk  3.04619 Cf  3.00775

Category:
atom_type_scat