Analysis and Assessment of Knowles’ Partitioning in Many-Body Perturbation Theory
Gombás, András, Surján, Péter R., Szabados, Ágnes
Published in Journal of chemical theory and computation (25.06.2024)
Published in Journal of chemical theory and computation (25.06.2024)
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Spin Symmetry and Size Consistency of Strongly Orthogonal Geminals
Jeszenszki, Péter, Surján, Péter R, Szabados, Ágnes
Published in Journal of chemical theory and computation (14.07.2015)
Published in Journal of chemical theory and computation (14.07.2015)
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Journal Article
Local spin from strongly orthogonal geminal wavefunctions
Jeszenszki, Péter, Rassolov, Vitaly, Surján, Péter R., Szabados, Ágnes
Published in Molecular physics (16.02.2015)
Published in Molecular physics (16.02.2015)
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The inverse boundary value problem: application in many-body perturbation theory
Surján, Péter R., Mihálka, Zsuzsanna É., Szabados, Ágnes
Published in Theoretical chemistry accounts (01.11.2018)
Published in Theoretical chemistry accounts (01.11.2018)
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Spin-adaptation and redundancy in state-specific multireference perturbation theory
Jeszenszki, Péter, Surján, Péter R, Szabados, Ágnes
Published in The Journal of chemical physics (28.03.2013)
Published in The Journal of chemical physics (28.03.2013)
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Perspectives of APSG-based multireference perturbation theories
Jeszenszki, Péter, Nagy, Péter R., Zoboki, Tamás, Szabados, Ágnes, Surján, Péter R.
Published in International journal of quantum chemistry (15.08.2014)
Published in International journal of quantum chemistry (15.08.2014)
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Journal Article
Generalized Møller−Plesset Partitioning in Multiconfiguration Perturbation Theory
Kobayashi, Masato, Szabados, Ágnes, Nakai, Hiromi, Surján, Péter R.
Published in Journal of chemical theory and computation (13.07.2010)
Published in Journal of chemical theory and computation (13.07.2010)
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Journal Article
Resonance Raman Optical Activity of Single Walled Chiral Carbon Nanotubes
Nagy, Péter R, Koltai, János, Surján, Péter R, Kürti, Jenő, Szabados, Ágnes
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (21.07.2016)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (21.07.2016)
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Journal Article
Strongly orthogonal geminals: size-extensive and variational reference states
Surján, Péter R., Szabados, Ágnes, Jeszenszki, Péter, Zoboki, Tamás
Published in Journal of mathematical chemistry (01.03.2012)
Published in Journal of mathematical chemistry (01.03.2012)
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Journal Article
Comparative study of multireference perturbative theories for ground and excited states
Hoffmann, Mark R, Datta, Dipayan, Das, Sanghamitra, Mukherjee, Debashis, Szabados, Agnes, Rolik, Zoltán, Surján, Péter R
Published in The Journal of chemical physics (28.11.2009)
Published in The Journal of chemical physics (28.11.2009)
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