Relativistic double-zeta, triple-zeta, and quadruple-zeta basis sets for the 5d elements Hf-Hg

Theoretical Chemistry Accounts

Volumn 112, Issue 5-6, 2004, Pages 403-409

  Dyall, Kenneth G ^a  

^a SCHRÖDINGER INC   (United States)

Author keywords

5d elements; Double zeta; Gaussian basis sets; Quadruple zeta; Relativistic basis sets; Triple zeta

Indexed keywords

HAFNIUM; MERCURY;

ARTICLE; DIPOLE; PARTICLE SIZE; POLARIZATION;

EID: 11944260897     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-004-0607-y     Document Type: Article

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