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There are 7360430 results for: content related to: Multiconfigurational spin-adapted single-reference coupled cluster formalism

  1. A Critical Assessment of Coupled Cluster Method in Quantum Chemistry

    Advances in Chemical Physics, Volume 110

    Josef Paldus, Xiangzhu Li, Pages: 1–175, 2007

    Published Online : 14 MAR 2007, DOI: 10.1002/9780470141694.ch1

  2. Electron correlation in one dimension: Coupled cluster approaches to cyclic polyene π-electron models

    International Journal of Quantum Chemistry

    Volume 42, Issue 1, 5 April 1992, Pages: 135–164, J. Paldus and P. Piecuch

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560420110

  3. The historical development of the electron correlation problem

    International Journal of Quantum Chemistry

    Volume 55, Issue 2, 15 July 1995, Pages: 77–102, Per-Olov Löwdin

    Version of Record online : 21 SEP 2004, DOI: 10.1002/qua.560550203

  4. Unitary-group-based open-shell coupled-cluster method with corrections for connected triexcited clusters. I. Theory

    International Journal of Quantum Chemistry

    Volume 70, Issue 1, 1998, Pages: 65–75, Xiangzhu Li and Josef Paldus

    Version of Record online : 12 OCT 1999, DOI: 10.1002/(SICI)1097-461X(1998)70:1<65::AID-QUA4>3.0.CO;2-3

  5. Unitary group approach to spin-adapted open-shell coupled cluster theory

    International Journal of Quantum Chemistry

    Volume 56, Issue 3, 5 November 1995, Pages: 129–155, Bogumił Jeziorski, Josef Paldus and Piotr Jankowski

    Version of Record online : 21 SEP 2004, DOI: 10.1002/qua.560560302

  6. On the solution of coupled-cluster equations in the fully correlated limit of cyclic polyene model

    International Journal of Quantum Chemistry

    Volume 40, Issue S25, 1991, Pages: 9–34, Piotr Piecuch and Josef Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560400807

  7. Coupled-Cluster approaches with an approximate account of triply and quadruply excited clusters: Implementation of the orthogonally spin-adapted CCD + ST(CCD), CCSD + T(CCSD), and ACPQ + ST(ACPQ) formalisms

    International Journal of Quantum Chemistry

    Volume 55, Issue 2, 15 July 1995, Pages: 133–146, Piotr Piecuch, Robert Toboła and Josef Paldus

    Version of Record online : 21 SEP 2004, DOI: 10.1002/qua.560550208

  8. Bond length alternation in cyclic polyenes. VI. Coupled cluster approach with wannier orbital basis

    International Journal of Quantum Chemistry

    Volume 28, Issue 4, October 1985, Pages: 459–479, M. Takahashi and J. Paldus

    Version of Record online : 4 APR 2005, DOI: 10.1002/qua.560280405

  9. Bonded tableau unitary group approach to the many-electron correlation problem

    International Journal of Quantum Chemistry

    Volume 36, Issue 5, November 1989, Pages: 599–632, Xiangzhu Li and Qianer Zhang

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560360507

  10. Diagnosis of the performance of the state-specific multireference coupled-cluster method with different truncation schemes

    Journal of Computational Chemistry

    Volume 33, Issue 14, 30 May 2012, Pages: 1285–1303, Uttam Sinha Mahapatra and Sudip Chattopadhyay

    Version of Record online : 15 MAR 2012, DOI: 10.1002/jcc.22960

  11. Explicit representation of Gel'fand–Tsetlin states in clifford algebra unitary group approach

    International Journal of Quantum Chemistry

    Volume 36, Issue 2, August 1989, Pages: 127–140, Xiangzhu Li and Josef Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560360205

  12. Behavior of coupled cluster energy in the strongly correlated limit of the cyclic polyene model. Comparison with the exact results

    International Journal of Quantum Chemistry

    Volume 42, Issue 1, 5 April 1992, Pages: 165–191, Piotr Piecuch, Jiří Čížek and Josef Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560420111

  13. Explicit algebraic form of coupled cluster equations for the PPP model of benzene with an approximate inclusion of triexcited clusters

    International Journal of Quantum Chemistry

    Volume 38, Issue 6, December 1990, Pages: 831–851, J. Čížek, J. Paldus and F. Vinette

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560380606

  14. PPP-VB Theory of π-Electron Systems: Electron Delocalization, Molecular Symmetry, and Resonance

    Israel Journal of Chemistry

    Volume 31, Issue 4, 1991, Pages: 351–362, Josef Paldus and Xiangzhu Li

    Version of Record online : 22 NOV 2013, DOI: 10.1002/ijch.199100040

  15. Multireference coupled-cluster methods for ground and low-lying excited states. A benchmark illustration on CH + potentials

    International Journal of Quantum Chemistry

    Volume 110, Issue 15, December 2010, Pages: 2734–2743, Xiangzhu Li and Josef Paldus

    Version of Record online : 19 AUG 2010, DOI: 10.1002/qua.22761

  16. Valence bond approach exploiting Clifford algebra realization of Rumer–Weyl basis

    International Journal of Quantum Chemistry

    Volume 41, Issue 1, 5 January 1992, Pages: 117–146, Xiangzhu Li and Josef Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560410112

  17. Cluster analysis of the full configuration interaction wave functions of cyclic polyene models

    International Journal of Quantum Chemistry

    Volume 22, Issue 6, December 1982, Pages: 1281–1305, J. Paldus and M. J. Boyle

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560220611

  18. Orthogonally spin-adapted coupled-cluster equations involving singly and doubly excited clusters. Comparison of different procedures for spin-adaptation

    International Journal of Quantum Chemistry

    Volume 36, Issue 4, October 1989, Pages: 429–453, Piotr Piecuch and Josef Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560360402

  19. Bond length alternation in cyclic polyenes. VII. Valence bond theory approach

    International Journal of Quantum Chemistry

    Volume 60, Issue 1, 5 October 1996, Pages: 513–527, Xiangzhu Li and Josef Paldus

    Version of Record online : 6 DEC 1998, DOI: 10.1002/(SICI)1097-461X(1996)60:1<513::AID-QUA50>3.0.CO;2-8

  20. Applicability of coupled-pair theories to quasidegenerate electronic states: A model study

    International Journal of Quantum Chemistry

    Volume 18, Issue 5, November 1980, Pages: 1243–1269, K. Jankowski and J. Paldus

    Version of Record online : 19 OCT 2004, DOI: 10.1002/qua.560180511