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Volumn 581, Issue 1-3, 2002, Pages 139-147
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Segmented contraction scheme for small-core lanthanide pseudopotential basis sets
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Author keywords
Basis sets; Ionization potentials; Lanthanides; Pseudopotentials; Spectroscopic constants
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Indexed keywords
LANTHANIDE;
LANTHANUM;
LUTETIUM;
METAL DERIVATIVE;
ACCURACY;
ANALYTIC METHOD;
ARTICLE;
CALCULATION;
CALIBRATION;
CHEMICAL ANALYSIS;
DENSITY FUNCTIONAL THEORY;
ELECTRIC POTENTIAL;
IONIZATION;
PUBLICATION;
QUANTUM THEORY;
STRUCTURE ANALYSIS;
SURFACE CHARGE;
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EID: 0037023161
PISSN: 01661280
EISSN: None
Source Type: Journal
DOI: 10.1016/S0166-1280(01)00751-5 Document Type: Article |
Times cited : (712)
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References (44)
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