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Volumn 238, Issue 1, 2006, Pages 72-78

Nuclear quadrupole coupling in chloroform and calibration of ab initio calculations

Author keywords

[No Author keywords available]

Indexed keywords

BENCHMARKING; GROUND STATE; SPECTROSCOPIC ANALYSIS; TENSORS;

EID: 33745222369     PISSN: 00222852     EISSN: 1096083X     Source Type: Journal    
DOI: 10.1016/j.jms.2006.04.011     Document Type: Article
Times cited : (10)

References (32)
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    • H.M. Pickett, SPFIT/SPCAT package, available from .
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    • Z. Kisiel, "PROSPE-Programs for ROtational SPEctroscopy", available from .
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    • 33745205777 scopus 로고    scopus 로고
    • Alex A. Granovsky, PC-GAMESS program, available from .
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    • 0002199283 scopus 로고
    • Durig J.R. (Ed), Elsevier, New York/Amsterdam
    • Watson J.K.G. In: Durig J.R. (Ed). Vibrational Spectra and Structure vol. 6 (1977), Elsevier, New York/Amsterdam 1-89
    • (1977) Vibrational Spectra and Structure , vol.6 , pp. 1-89
    • Watson, J.K.G.1
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    • J.H. Holloway, PhD Thesis, Massachussetts Institute of Technology, Cambridge, MA, 1956.
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    • 33745187294 scopus 로고    scopus 로고
    • W. Bailey, "Calculation of Nuclear Quadrupole Coupling Constants in Gaseous State Molecules", available from .
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    • 33745208378 scopus 로고    scopus 로고
    • Extensible Computational Chemistry Environment Basis Set Database, developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, Washington 99352, USA, and funded by the U.S. Department of Energy, available from .


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.