Počet záznamov: 1
CC-R12: An explicitly correlated coupled-cluster theory
Názov CC-R12: An explicitly correlated coupled-cluster theory Autor Noga Jozef 1955 SAVANOCH - Ústav anorganickej chémie SAV Spoluautori Klopper Wim Kutzelnigg Werner Zdroj.dok. / Bartlett R.J. Recent Advances in Computational Chemistry Vol. 3. P. 1-49. - Londyn : World Scientific, 1997 Jazyk dok. eng - angličtina Druh dok. rozpis článkov z periodík (rzb) Ohlasy HELLMANN, R. - BICH, E. - VOGEL, E. Ab initio potential energy curve for the helium atom pair and thermophysical properties of dilute helium gas. I. Helium-helium interatomic potential. In MOLECULAR PHYSICS. ISSN 0026-8976, DEC 10 2007, vol. 105, no. 23-24, p. 3013-3023. TEN-NO, S. A simple F12 geminal correction in multi-reference perturbation theory. In CHEMICAL PHYSICS LETTERS. ISSN 0009-2614, OCT 15 2007, vol. 447, no. 1-3, p. 175-179. CRAWFORD, T.D. - SHERRILL, C.D. - VALEEV, E.F. - FERMANN, J.T. - KING, R.A. - LEININGER, M.L. - BROWN, S.T. - JANSSEN, C.L. - SEIDL, E.T. - KENNY, J.P. - ALLEN, W.D. PS13: An open-source ab initio electronic structure package. In JOURNAL OF COMPUTATIONAL CHEMISTRY. ISSN 0192-8651, JUL 15 2007, vol. 28, no. 9, p. 1610-1616. SHIOZAKI, T. - KAMIYA, M. - HIRATA, S. - VALEEV, E.F. Explicitly correlated coupled-cluster singles and doubles method based on complete diagrammatic equations. In JOURNAL OF CHEMICAL PHYSICS. ISSN 0021-9606, AUG 21 2008, vol. 129, no. 7. VALEEV, E.F. - CRAWFORD, T.D. Simple coupled-cluster singles and doubles method with perturbative inclusion of triples and explicitly correlated geminals: The CCSD(T)((R12)over-bar) model. In JOURNAL OF CHEMICAL PHYSICS. ISSN 0021-9606, JUN 28 2008, vol. 128, no. 24. SHIOZAKI, T. - KAMIYA, M. - HIRATA, S. - VALEEV, E.F. Equations of explicitly-correlated coupled-cluster methods. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, 2008, vol. 10, no. 23, p. 3358-3370. TORHEYDEN, M. - VALEEV, E.F. Variational formulation of perturbative explicitly-correlated coupled-cluster methods. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, 2008, vol. 10, no. 23, p. 3410-3420. VARANDAS, A.J.C. Can extrapolation to the basis set limit be an alternative to the counterpoise correction? A study on the helium dimer. In THEORETICAL CHEMISTRY ACCOUNTS. ISSN 1432-881X, APR 2008, vol. 119, no. 5-6, p. 511-521. VALEEV, E.F. Coupled-cluster methods with perturbative inclusion of explicitly correlated terms: a preliminary investigation. In PHYSICAL CHEMISTRY CHEMICAL PHYSICS. ISSN 1463-9076, 2008, vol. 10, no. 1, p. 106-113. SHIOZAKI, T. - KAMIYA, M. - HIRATA, S. - VALEEV, E.F. Higher-order explicitly correlated coupled-cluster methods. In JOURNAL OF CHEMICAL PHYSICS. ISSN 0021-9606, FEB 7 2009, vol. 130, no. 5. BOKHAN, D. - BERNADOTTE, S. - TEN-NO, S. Implementation of the CCSD(T)(F12) method using numerical quadratures. In CHEMICAL PHYSICS LETTERS. ISSN 0009-2614, FEB 3 2009, vol. 469, no. 1-3, p. 214-218. BOKHAN, D. - TEN-NO, S. Explicitly correlated equation-of-motion coupled-cluster methods for excited and electron-attached states (Retracted Article. See vol 134, ARTN 109901, 2011). In JOURNAL OF CHEMICAL PHYSICS. ISSN 0021-9606, NOV 28 2010, vol. 133, no. 20. VARANDAS, A.J.C. Extrapolation to the Complete Basis Set Limit without Counterpoise. The Pair Potential of Helium Revisited. In JOURNAL OF PHYSICAL CHEMISTRY A. ISSN 1089-5639, AUG 26 2010, vol. 114, no. 33, p. 8505-8516. BOKHAN, D. - TEN-NO, S. Communications: Explicitly correlated equation-of-motion coupled cluster method for ionized states. In JOURNAL OF CHEMICAL PHYSICS. ISSN 0021-9606, JAN 14 2010, vol. 132, no. 2. SPIEGELMAN, F. - RAPACIOLI, M. - SIMON, A. Perspectives from quantum chemistry for molecules and nanograins with astrophysical interest. In CHEMISTRY IN ASTROPHYSICAL MEDIA, ASTROPH 2010. ISSN 2100-014X, 2011, vol. 18, article number 06003 Kategória ABC - Kapitoly vo vedeckých monografiách vydané v zahraničných vydavateľstvách Kategória (od 2022) V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníka Typ výstupu kapitola Rok vykazovania 1997 
článok
rok vydania rok metriky IF IF Q (best) SJR SJR Q (best) 1997
Počet záznamov: 1