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Volumn 131, Issue 3, 2012, Pages 1-20

Relativistic double-zeta, triple-zeta, and quadruple-zeta basis sets for the 7p elements, with atomic and molecular applications

Author keywords

7p elements; Correlating functions; Double zeta; Gaussian basis sets; Quadruple zeta; Relativistic basis sets; Triple zeta

Indexed keywords


EID: 84857745464     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-012-1172-4     Document Type: Article
Times cited : (77)

References (68)
  • 19
    • 1542724724 scopus 로고    scopus 로고
    • Two-component relativistic effective core potential calculations for molecules
    • In: Schwerdtfeger P (eds), Elsevier, Amsterdam
    • Lee YS (2004) Two-component relativistic effective core potential calculations for molecules. In: Schwerdtfeger P (eds) Relativistic electronic structure theory part 2: applications, Elsevier, Amsterdam, p 352.
    • (2004) Relativistic Electronic Structure Theory Part 2: Applications , pp. 352
    • Lee, Y.S.1
  • 58
    • 0002502467 scopus 로고
    • Polyatomic molecular Dirac-Hartree-Fock calculations with Gaussian basis sets: Theory, implementation and applications
    • In: Malli GL, Plenum, New York
    • Dyall KG (1994) Polyatomic molecular Dirac-Hartree-Fock calculations with Gaussian basis sets: theory, implementation and applications. In: Malli GL (ed) Relativistic and correlation effects in molecules and solids, Plenum, New York, p 17.
    • (1994) Relativistic and Correlation Effects In Molecules and Solids , pp. 17
    • Dyall, K.G.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.