메뉴 건너뛰기




Volumn 3, Issue 4, 2007, Pages 1368-1377

Parallel calculation of coupled cluster singles and doubles wave functions using array files

Author keywords

[No Author keywords available]

Indexed keywords


EID: 34848892865     PISSN: 15499618     EISSN: None     Source Type: Journal    
DOI: 10.1021/ct700048u     Document Type: Article
Times cited : (68)

References (53)
  • 2
    • 0003418036 scopus 로고
    • Yarkony, D. R, Ed, World Scientific: Singapore
    • Bartlett, R. J. In Modern Electronic Structure Theory; Yarkony, D. R., Ed.; World Scientific: Singapore, 1995; pp 1047-1131.
    • (1995) Modern Electronic Structure Theory , pp. 1047-1131
    • Bartlett, R.J.1
  • 16
    • 36048977435 scopus 로고    scopus 로고
    • See
    • See: www.pqs-chem.com.
  • 21
    • 36049015980 scopus 로고    scopus 로고
    • MOLPRO, a package of ab initio programs designed by H.-J. Werner and P. J. Knowles. Amos, R. D, Bernhardsson, A, Berning, A, Celani, P, Cooper, D. L, Deegan, M. J. O, Dobbyn, A. J, Eckert, F, Hampel, C, Hetzer, G, Knowles, P. J, Korona, T, Lindh, R, Lloyd, A.W, McNicholas, S. J, Manby, F. R, Meyer, W, Mura, M. E, Nicklass, A, Palmieri, P, Pitzer, R, Rauhut, G, Schütz, M, Schumann, U, Stoll, H, Stone, A. J, Tarroni, R, Thorsteinsson, T, Werner, H.-J. Version 2002.1
    • MOLPRO, a package of ab initio programs designed by H.-J. Werner and P. J. Knowles. Amos, R. D.; Bernhardsson, A.; Berning, A.; Celani, P.; Cooper, D. L.; Deegan, M. J. O.; Dobbyn, A. J.; Eckert, F.; Hampel, C.; Hetzer, G.; Knowles, P. J.; Korona, T.; Lindh, R.; Lloyd, A.W.; McNicholas, S. J.; Manby, F. R.; Meyer, W.; Mura, M. E.; Nicklass, A.; Palmieri, P.; Pitzer, R.; Rauhut, G.; Schütz, M.; Schumann, U.; Stoll, H.; Stone, A. J.; Tarroni, R.; Thorsteinsson, T.; Werner, H.-J. Version 2002.1.
  • 23
    • 36048931593 scopus 로고    scopus 로고
    • PQS version 3.2; Parallel Quantum Solutions, 2013 Green Acres Road, Fayetteville, AR 72703; 2005. See
    • PQS version 3.2; Parallel Quantum Solutions, 2013 Green Acres Road, Fayetteville, AR 72703; 2005. See: www.pqs-chem.com.
  • 25
    • 36048997418 scopus 로고    scopus 로고
    • accessed September 2006
    • http://www.msg.ameslab.gov/GAMESS/changes.html (accessed September 2006).
  • 26
    • 36048993641 scopus 로고    scopus 로고
    • private communication
    • Szalay, P.; Gauss, J. private communication, 2006.
    • (2006)
    • Szalay, P.1    Gauss, J.2
  • 27
    • 36049008962 scopus 로고    scopus 로고
    • Stanton, J. F.; Gauss, J.; Watts, J. D.; Szalay, P. G.; Bartlett, R. J. with contributions from Auer, A. A.; Bernholdt, D. B.; Christiansen, O.; Harding, M. E.; Heckert, M.; Heun, O.; Huber, C.; Jonsson, D.; Jusélius, J.; Lauderdale, W. J.; Metzroth, T.; Ruud, K. and the integral packages: MOLECULE (J. Almlöf and P. R. Taylor), PROPS (P. R. Taylor), and ABACUS (T. Helgaker, H. J. Aa. Jensen, P. Jørgensen, and J. Olsen).
    • Stanton, J. F.; Gauss, J.; Watts, J. D.; Szalay, P. G.; Bartlett, R. J. with contributions from Auer, A. A.; Bernholdt, D. B.; Christiansen, O.; Harding, M. E.; Heckert, M.; Heun, O.; Huber, C.; Jonsson, D.; Jusélius, J.; Lauderdale, W. J.; Metzroth, T.; Ruud, K. and the integral packages: MOLECULE (J. Almlöf and P. R. Taylor), PROPS (P. R. Taylor), and ABACUS (T. Helgaker, H. J. Aa. Jensen, P. Jørgensen, and J. Olsen).


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.