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Péter R. Surján, Kevin Simon & Á. Szabados. (2023) Stability analysis of the Lippmann–Schwinger equation. Molecular Physics 121:11-12.
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I. HUBA[Cbreve]P. MACH & S. WILSON. (2003)
A posteriori Brillouin—Wigner correction of limited multireference configuration interaction: analysis for an (H2)4 cluster model. Molecular Physics 101:23-24, pages 3493-3511.
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Articles from other publishers (18)
Sudip Chattopadhyay. (2021) Single-Root Multireference Brillouin–Wigner Perturbative Approach to Excitation Energies. ACS Omega 6:2, pages 1668-1686.
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Shovan Manna, Rajat K. Chaudhuri & Sudip Chattopadhyay. (2020) Taming the excited states of butadiene, hexatriene, and octatetraene using state specific multireference perturbation theory with density functional theory orbitals. The Journal of Chemical Physics 152:24.
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Sudip Chattopadhyay. (2020) Investigation of Multiple-Bond Dissociation Using Brillouin–Wigner Perturbation with Improved Virtual Orbitals. The Journal of Physical Chemistry A 124:7, pages 1444-1463.
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Shovan Manna, Suvonil Sinha Ray, Sudip Chattopadhyay & Rajat K. Chaudhuri. (2019) A simplified account of the correlation effects to bond breaking processes: The Brillouin-Wigner perturbation theory using a multireference formulation. The Journal of Chemical Physics 151:6.
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Uğur Bozkaya. (2019) Efficient Implementation of the Second-Order Quasidegenerate Perturbation Theory with Density-Fitting and Cholesky Decomposition Approximations: Is It Possible To Use Hartree–Fock Orbitals for a Multiconfigurational Perturbation Theory?. Journal of Chemical Theory and Computation 15:8, pages 4415-4429.
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Suvonil Sinha Ray, Pradipta Ghosh, Rajat K. Chaudhuri & Sudip Chattopadhyay. (2017) Improved virtual orbitals in state specific multireference perturbation theory for prototypes of quasidegenerate electronic structure. The Journal of Chemical Physics 146:6, pages 064111.
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Suvonil Sinha Ray, Anirban Ghosh, Sudip Chattopadhyay & Rajat K. Chaudhuri. (2016) Taming the Electronic Structure of Diradicals through the Window of Computationally Cost Effective Multireference Perturbation Theory. The Journal of Physical Chemistry A 120:29, pages 5897-5916.
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Sudip Chattopadhyay, Rajat K Chaudhuri, Uttam Sinha Mahapatra, Anirban Ghosh & Suvonil Sinha Ray. (2016) State-specific multireference perturbation theory: development and present status. Wiley Interdisciplinary Reviews: Computational Molecular Science 6:3, pages 266-291.
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Saeed Nasiri & Mansour Zahedi. (2015) Accurate potential energy curves of Li2 and LiH: A Quantum Monte-Carlo (QMC) study. Chemical Physics Letters 634, pages 101-107.
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Sudip Chattopadhyay, Uttam Sinha Mahapatra & Rajat K. Chaudhuri. (2012) State specific multireference Møller–Plesset perturbation theory: A few applications to ground, excited and ionized states. Chemical Physics 401, pages 15-26.
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Sudip Chattopadhyay, Uttam Sinha Mahapatra & Rajat K. Chaudhuri. (2012) State-specific complete active space multireference Møller–Plesset perturbation approach for multireference situations: illustrating the bond breaking in hydrogen halides. Theoretical Chemistry Accounts 131:4.
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Uttam Sinha Mahapatra, Sudip Chattopadhyay & Rajat K. Chaudhuri. (2010) Second‐order state‐specific multireference Møller Plesset perturbation theory: Application to energy surfaces of diimide, ethylene, butadiene, and cyclobutadiene. Journal of Computational Chemistry 32:2, pages 325-337.
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Uttam Sinha Mahapatra, Sudip Chattopadhyay & Rajat K Chaudhuri. (2010) Study of the Ground State Dissociation of Diatomic Molecular Systems Using State-Specific Multireference Perturbation Theory: A Brillouin−Wigner Scheme. Journal of Chemical Theory and Computation 6:3, pages 662-682.
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Sudip Chattopadhyay, Uttam Sinha Mahapatra & Rajat K. Chaudhuri. (2010) Study of equilibrium geometries of diradicaloid systems via state specific multireference Møller–Plesset perturbation theory (SS-MRMPPT). Chemical Physics Letters 488:4-6, pages 229-234.
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Francesco A. Evangelista, Andrew C. Simmonett, Henry F. Schaefer III, Debashis Mukherjee & Wesley D. Allen. (2009) A companion perturbation theory for state-specific multireference coupled cluster methods. Physical Chemistry Chemical Physics 11:23, pages 4728.
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Angelo M. Maniero & Paulo H. Acioli. (2005) Full configuration interaction pseudopotential determination of the ground-state potential energy curves of Li2 and LiH. International Journal of Quantum Chemistry 103:5, pages 711-717.
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S. Wilson, I. Hubač, P. Mach, J. Pittner & P. Čársky. 2003. Advanced Topics in Theoretical Chemical Physics. Advanced Topics in Theoretical Chemical Physics
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I. Hubac & S. Wilson. (2002) On the Estimation of the Remainder Term in Møller-Plesset MP2 Theory from Limited Configuration Interaction. International Journal of Molecular Sciences 3:5, pages 570-578.
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