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Phase transition in GeF2driven by change of type of intermolecular interaction
Usvyat, Denis
, Yin, Congling , Wälz, Gero, Mühle, Claus, Schütz, Martin and Jansen, Martin
(2012)
Phase transition in GeF2driven by change of type of intermolecular interaction.
Physical Review B 86 (5).
Date of publication of this fulltext: 19 Dec 2024 09:38
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| Item type | Article | ||||
| Journal or Publication Title | Physical Review B | ||||
| Publisher: | AMER PHYSICAL SOC | ||||
|---|---|---|---|---|---|
| Place of Publication: | COLLEGE PK | ||||
| Volume: | 86 | ||||
| Number of Issue or Book Chapter: | 5 | ||||
| Date | 2012 | ||||
| Institutions | Chemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie > Research Group Theoretical Chemistry > Prof. Dr. Martin Schütz Chemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie > Research Group Theoretical Chemistry > PD Dr. Denis Usvyat | ||||
| Identification Number |
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| Keywords | ADAPTED PERTURBATION-THEORY; DENSITY-FUNCTIONAL THEORY; CONSISTENT BASIS-SETS; KOHN-SHAM ORBITALS; ELECTRON CORRELATION; PSEUDOPOTENTIALS; PROGRAM; CRYSCOR; DNA; | ||||
| Dewey Decimal Classification | 500 Science > 540 Chemistry & allied sciences | ||||
| Status | Published | ||||
| Refereed | Yes, this version has been refereed | ||||
| Created at the University of Regensburg | Yes | ||||
| Item ID | 63516 |
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