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Volumn 6, Issue 40, 1994, Pages 8245-8257
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Norm-conserving and ultrasoft pseudopotentials for first-row and transition elements
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Author keywords
[No Author keywords available]
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Indexed keywords
DENSITY FUNCTIONAL THEORY;
LOCAL DENSITY APPROXIMATION;
MOLECULAR DYNAMICS;
NORM CONSERVING PSEUDOPOTENTIALS;
PLANE WAVE CONVERGENCE;
PSEUDOWAVEFUNCTION;
TRANSFERABILITY;
ULTRASOFT PSEUDOPOTENTIALS;
VANDERBILT OPTIMAL COMPROMISE;
APPROXIMATION THEORY;
ELECTRON ENERGY LEVELS;
OPTIMIZATION;
STATISTICAL MECHANICS;
TRANSITION METALS;
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EID: 0028763270
PISSN: 09538984
EISSN: None
Source Type: Journal
DOI: 10.1088/0953-8984/6/40/015 Document Type: Article |
Times cited : (3918)
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References (33)
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