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Volumn 125, Issue 10, 2006, Pages

Ground and electronically excited states of methyl hydroperoxide: Comparison with hydrogen peroxide

Author keywords

[No Author keywords available]

Indexed keywords

DIPOLE MOMENTS; METHYL HYDROPEROXIDE; QUADRATIC CONFIGURATION INTERACTION METHODS;

EID: 33748680350     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2338039     Document Type: Article
Times cited : (32)

References (50)
  • 33
    • 0007136498 scopus 로고    scopus 로고
    • as 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, WA 99352, and funded by the U.S. Department of Energy. The Pacific Northwest Laboratory is a multiprogram laboratory operated by Battelle Memorial Institute for the U.S. Department of Energy under Contract No. DE-AC06-76RLO 1830. Contact David Feller, Karen Schuchardt, or Don Jones for further information
    • Basis sets in ACES II were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0, as 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, WA 99352, and funded by the U.S. Department of Energy. The Pacific Northwest Laboratory is a multiprogram laboratory operated by Battelle Memorial Institute for the U.S. Department of Energy under Contract No. DE-AC06-76RLO 1830. Contact David Feller, Karen Schuchardt, or Don Jones for further information.
    • Extensible Computational Chemistry Environment Basis Set Database, Version 1.0


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