COL  ICSD Collection Code 73351
 DATE Recorded Jun 30, 1994
 NAME Copper(I) indium selenide
 FORM Cu In Se2
      = Cu In Se2
 TITL The crystal structures of CuInSe2 and CuInTe2
 REF  Materials Research Bulletin
      MRBUA 27 (1992) 161-167
 AUT  Knight K S
 CELL a=5.781 b=5.781 c=11.642 à=90.0 á=90.0 ç=90.0
      V=389.1 Z=4
 SGR  I -4 2 d      (122) - tetragonal
 CLAS -42m  (Hermann-Mauguin) - D2d (Schoenflies)
 PRS  tI16
 ANX  ABX2
 PARM Atom__No OxStat  Wyck ---X--- ---Y--- ---Z---  -SOF-
      Cu     1  1.000    4a  0.      0.      0.
      In     1  3.000    4b  0.      0.      1/2
      Se     1 -2.000    8d  0.226   1/4     1/8
 WYCK d b a
ÿ
 TF   Atom   U(1,1)  U(2,2)  U(3,3)  U(1,2)  U(1,3)  U(2,3)
      Cu 1    0.0218  0.0218  0.0245  0.0000  0.0000  0.0000
      In 1    0.0130  0.0130  0.0140  0.0000  0.0000  0.0000
      Se 1    0.0110  0.0129  0.0136  0.0000 -0.0015  0.0000
 RVAL 0.034