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Volumn 103, Issue 1, 1999, Pages 166-170

Ground state of the (H2O)2+ radical cation: DFT versus post-Hartree - Fock methods

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EID: 0001518498     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp983195u     Document Type: Article
Times cited : (231)

References (30)
  • 23
    • 0002745201 scopus 로고
    • MOLPRO is a package of ab initio programs written by H.-J. Werner and P. J. Knowles, with contributions from J. Almlöf, R. D. Amos, A. Berning, M. J. O. Deegan, F. Eckert, S. T. Elbert, C. Hampel, R. Lindh, W. Meyer, A. Nicklass, K. Peterson, R. Pitzer, A. J. Stone, P. R. Taylor, M. E. Mura, P. Pulay, M. Schuetz, H. Stoll, T. Thorsteinsson, and D. L. Cooper. The CCSD program is described in the following: Hampel, C.; Peterson, K.; Werner, H.-J. Chem. Phys. Lett. 1992, 190, 1.
    • (1992) Chem. Phys. Lett. , vol.190 , pp. 1
    • Hampel, C.1    Peterson, K.2    Werner, H.-J.3
  • 30
    • 16444367846 scopus 로고    scopus 로고
    • Personal communication
    • Bickelhaupt, F. M. Personal communication.
    • Bickelhaupt, F.M.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.