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Volumn 501, Issue 4-6, 2011, Pages 308-314

Probing the structures and thermodynamic characteristics of the environment polluting mercuric halides, cyanides and thiocyanates

Author keywords

[No Author keywords available]

Indexed keywords

AQUEOUS MEDIUM; CONDUCTOR-LIKE SCREENING; COUPLED-CLUSTER CALCULATIONS; DOUBLE EXCITATIONS; EXPERIMENTAL DATA; GASPHASE; GIBBS FREE ENERGY OF FORMATION; OPTIMIZED STRUCTURES; POLARIZED CONTINUUM MODELS; REACTION FIELDS; THERMODYNAMIC CHARACTERISTICS;

EID: 78650835476     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2010.11.043     Document Type: Article
Times cited : (3)

References (45)
  • 24
    • 78650812660 scopus 로고    scopus 로고
    • The d- and f- Polarization Functions were used as such in the Present Calculations
    • The d-and f-Polarization Functions are taken from GAMESS web site < http://www.msg.ameslab.gov/GAMESS/GAMESS-Manual/refs.pdf >. The d- and f-Polarization Functions were used as such in the Present Calculations.
    • The D-and F-Polarization Functions Are Taken from GAMESS Web Site
  • 30
    • 0038626673 scopus 로고    scopus 로고
    • revision C.02 Gaussian Inc. Wallingford, CT
    • M.J. Frisch Gaussian 03, revision C.02 2004 Gaussian Inc. Wallingford, CT
    • (2004) Gaussian 03
    • Frisch, M.J.1
  • 31
    • 70450206724 scopus 로고    scopus 로고
    • Revision A.1 Gaussian Inc. Wallingford, CT
    • M.J. Frisch Gaussian 09, Revision A.1 2009 Gaussian Inc. Wallingford, CT
    • (2009) Gaussian 09
    • Frisch, M.J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.