High pressure behavior of mercury difluoride (HgF2)
نویسندگان
چکیده
منابع مشابه
HIGH PRESSURE BEHAVIOR OF KCl: STRUCTURAL AND ELECTRONIC PROPERTIES
The high pressure behavior of the structural and electronic properties of KC1 is studied with use of the density functional pseudopotential method within local-density approximation. Atzero pressure, the rocksalt phase is found to be lower in energy than CsCl structure. However, we predict a phase transition into CsCI structure at a pressure of about 1.5 GPa. The calculated ground state pro...
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the high pressure behavior of the structural and electronic properties of kc1 is studied with use of the density functional pseudopotential method within local-density approximation. atzero pressure, the rocksalt phase is found to be lower in energy than cscl structure. however, we predict a phase transition into csci structure at a pressure of about 1.5 gpa. the calculated ground state propert...
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The High Pressure Behavior of Cristobalite
The most abundant rock-forming minerals in the eanh's crust are framework silicates with complex crystal structures. These materials displaya remarkable chemical and structUral diversity. In addition,~structUral phase transitions involving displacive distonions are panicularly common, leading to yet more structural variation. There have been suggestions that the distonive behavior of the framew...
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ژورنال
عنوان ژورنال: Chemical Physics Letters
سال: 2019
ISSN: 0009-2614
DOI: 10.1016/j.cplett.2019.03.045