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Volumn 23, Issue 5, 2011, Pages
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First-priniples study on thermodynamic properties and phase transitions in TiS2
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Author keywords
[No Author keywords available]
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Indexed keywords
AMBIENT CONDITIONS;
DENSITY-FUNCTIONAL CALCULATIONS;
DICHALCOGENIDES;
ELECTRON DENSITY ANALYSIS;
EXPERIMENTAL DATA;
HARMONIC APPROXIMATION;
HIGH PRESSURE;
HIGH TEMPERATURE;
PHASE STABLE;
PHONON DISPERSIONS;
PRESSURE RANGES;
PRESSURE-INDUCED PHASE TRANSITION;
TETRAGONAL PHASE;
TI ATOMS;
UNIT CELL LENGTH;
VALENCE ELECTRON;
VIBRATIONAL PROPERTIES;
DENSITY FUNCTIONAL THEORY;
PHONONS;
THERMODYNAMIC PROPERTIES;
TRANSITION METALS;
PHASE TRANSITIONS;
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EID: 79551663052
PISSN: 09538984
EISSN: 1361648X
Source Type: Journal
DOI: 10.1088/0953-8984/23/5/055401 Document Type: Article |
Times cited : (32)
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References (54)
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