Geminal perturbation theory based on the unrestricted Hartree-Fock wavefunction
Földvári, D, Tóth, Zs, Surján, P R, Szabados, Á
Published in The Journal of chemical physics (21.01.2019)
Published in The Journal of chemical physics (21.01.2019)
Get more information
Journal Article
The γ function in quantum theory II. Mathematical challenges and paradoxa
Mihálka, Zs. É., Nooijen, M., Margócsy, Á., Szabados, Á., Surján, P. R.
Published in Journal of mathematical chemistry (2022)
Published in Journal of mathematical chemistry (2022)
Get full text
Journal Article
Half-Projection of the Strongly Orthogonal Unrestricted Geminals’ Product Wave Function
Mihálka, Zs. É, Surján, P. R, Szabados, Á
Published in Journal of chemical theory and computation (11.02.2020)
Published in Journal of chemical theory and computation (11.02.2020)
Get full text
Journal Article
Physico-chemical characterization and in vitro/ in vivo evaluation of loratadine:dimethyl-β-cyclodextrin inclusion complexes
Szabados-Nacsa, Á., Sipos, P., Martinek, T., Mándity, I., Blazsó, G., Balogh, Á., Szabó-Révész, P., Aigner, Z.
Published in Journal of pharmaceutical and biomedical analysis (15.05.2011)
Published in Journal of pharmaceutical and biomedical analysis (15.05.2011)
Get full text
Journal Article
Semiconductor-to-metal transition of double walled carbon nanotubes induced by inter-shell interaction
Zólyomi, V., Rusznyák, Á., Kürti, J., Gali, Á., Simon, F., Kuzmany, H., Szabados, Á., Surján, P. R.
Published in Physica Status Solidi (b) (01.11.2006)
Published in Physica Status Solidi (b) (01.11.2006)
Get full text
Journal Article
Conference Proceeding
Symmetry-Adapted Perturbation with Half-Projection for Spin Unrestricted Geminals
Mihálka, Zs. É, Surján, P. R, Szabados, Á
Published in Journal of chemical theory and computation (13.07.2021)
Published in Journal of chemical theory and computation (13.07.2021)
Get full text
Journal Article
The \documentclass[12pt]{minimal} \usepackage{amsmath} \usepackage{wasysym} \usepackage{amsfonts} \usepackage{amssymb} \usepackage{amsbsy} \usepackage{mathrsfs} \usepackage{upgreek} \setlength{\oddsidemargin}{-69pt} \begin{document}$$\gamma$$\end{document}γ function in quantum theory II. Mathematical challenges and paradoxa
Mihálka, Zs. É., Nooijen, M., Margócsy, Á., Szabados, Á., Surján, P. R.
Published in Journal of mathematical chemistry (04.12.2021)
Published in Journal of mathematical chemistry (04.12.2021)
Get full text
Journal Article
Calculation of correlation-corrected band structures of polymers in the case of quasi-degeneracy
Surján, P.R., Szabados, Á, Bogár, F., Ladik, J.
Published in Solid state communications (01.09.1997)
Published in Solid state communications (01.09.1997)
Get full text
Journal Article
Coupled-cluster theory and the method of moments
Rolik, Z., Szabados, Á., Kőhalmi, D., Surján, P.R.
Published in Journal of molecular structure. Theochem (31.08.2006)
Published in Journal of molecular structure. Theochem (31.08.2006)
Get full text
Journal Article
On the killer condition in the equation-of-motion method : Ionization potentials from multi-reference wave functions
SZEKERES, Zsolt, SZABADOS, Agnes, KALLAY, Mihaly, SURJAN, Péter R
Published in PCCP. Physical chemistry chemical physics (Print) (2001)
Published in PCCP. Physical chemistry chemical physics (Print) (2001)
Get full text
Conference Proceeding
Journal Article
Total Synthesis of Garcifuran B
Kelly, T. Ross, Szabados, Andreas, Lee, Yean-Jang
Published in Journal of organic chemistry (24.01.1997)
Published in Journal of organic chemistry (24.01.1997)
Get full text
Journal Article
Multiconfiguration perturbation theory: size consistency at second order
Szabados, Agnes, Rolik, Zoltán, Tóth, Gábor, Surján, Péter R
Published in The Journal of chemical physics (15.03.2005)
Published in The Journal of chemical physics (15.03.2005)
Get more information
Journal Article
Comparison of low-order multireference many-body perturbation theories
Chaudhuri, Rajat K, Freed, Karl F, Hose, Gabriel, Piecuch, Piotr, Kowalski, Karol, Włoch, Marta, Chattopadhyay, Sudip, Mukherjee, Debashis, Rolik, Zoltán, Szabados, Agnes, Tóth, Gábor, Surján, Péter R
Published in The Journal of chemical physics (01.04.2005)
Published in The Journal of chemical physics (01.04.2005)
Get more information
Journal Article