THE HIGH-PRESSURE PHASE OF ZINCITE

被引:94
作者
GERWARD, L [1 ]
OLSEN, JS [1 ]
机构
[1] UNIV COPENHAGEN,NIELS BOHR INST,OERSTED LAB,DK-2100 COPENHAGEN,DENMARK
关键词
HIGH-PRESSURE PHASES; PHASE TRANSFORMATIONS; ENERGY-DISPERSIVE POWDER DIFFRACTION; EQUATION OF STATE; ZINCITE;
D O I
10.1107/S0909049595009447
中图分类号
TH7 [仪器、仪表];
学科分类号
0804 ; 080401 ; 081102 ;
摘要
Synchrotron-radiation X-ray diffraction studies of ZnO have been performed with special emphasis on the rock-salt-type high-pressure phase. The wurtzite (B4) to rock salt (B1) phase transformation is accompanied by a volume collapse of 18%, which is a very large effect. The lattice constant of the B1 phase at ambient pressure is a(0) = 4.280(4) Angstrom, and the bulk modulus is B-0 = 170(10) GPa. Comparisons are made with a recently published theoretical equation of state obtained from ab initio perturbed-ion calculations.
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页码:233 / 235
页数:3
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