Zobrazeno 1 - 10
of 25
pro vyhledávání: '"Máté, Mihály"'
Heavy atom compounds represent a challenge for computational chemistry, due to the need for simultaneous treatment of relativistic and correlation effects. Often such systems exhibit also strong correlation which hampers the application of perturbati
Externí odkaz:
http://arxiv.org/abs/2403.18473
In this work, we present a brief overview of the fermionic mode optimization within the framework of tensor network state methods [PRL 117,210402(2016)], and demonstrate that it has the potential to compress the multireference character of the wave f
Externí odkaz:
http://arxiv.org/abs/2204.13531
Tailored coupled cluster theory represents a computationally inexpensive way to describe static and dynamical electron correlation effects. In this work, we scrutinize the performance of various tailored coupled cluster methods externally corrected b
Externí odkaz:
http://arxiv.org/abs/2103.12381
Autor:
Szalay, Szilárd, Zimborás, Zoltán, Máté, Mihály, Barcza, Gergely, Schilling, Christian, Legeza, Örs
Publikováno v:
J. Phys. A: Math. Theor. 54, 393001 (2021)
The operator algebra of fermionic modes is isomorphic to that of qubits, the difference between them is twofold: the embedding of subalgebras corresponding to mode subsets and multiqubit subsystems on the one hand, and the parity superselection in th
Externí odkaz:
http://arxiv.org/abs/2006.03087
Publikováno v:
Commun. Phys. 4, 29 (2021)
The realization of Bose-Einstein condensation in ultracold trapped gases has led to a revival of interest in that fascinating quantum phenomenon. This experimental achievement necessitated both extremely low temperatures and sufficiently weak interac
Externí odkaz:
http://arxiv.org/abs/2002.09997
Autor:
Faulstich, Fabian M., Máté, Mihály, Laestadius, Andre, Csirik, Mihály András, Veis, Libor, Antalik, Andrej, Brabec, Jiří, Schneider, Reinhold, Pittner, Jiří, Kvaal, Simen, Legeza, Örs
In this article, we investigate the numerical and theoretical aspects of the coupled-cluster method tailored by matrix-product states. We investigate chemical properties of the used method, such as energy size extensivity and the equivalence of linke
Externí odkaz:
http://arxiv.org/abs/1809.07732
Autor:
Višňák, Jakub, Brandejs, Jan, Máté, Mihály, Visscher, Lucas, Legeza, Örs, Pittner, Jiří
Publikováno v:
Journal of Chemical Theory and Computation; October 2024, Vol. 20 Issue: 20 p8862-8875, 14p
Autor:
Máté, Mihály1,2 (AUTHOR), Petrov, Klára1 (AUTHOR), Szalay, Szilárd1,3,4 (AUTHOR), Legeza, Örs1,5 (AUTHOR) legeza.ors@wigner.hu
Publikováno v:
Journal of Mathematical Chemistry. Feb2023, Vol. 61 Issue 2, p362-375. 14p.
Autor:
Máté, Mihály1,2, Legeza, Örs1, Schilling, Rolf3, Yousif, Mason4, Schilling, Christian4,5 c.schilling@physik.uni-muenchen.de
Publikováno v:
Communications Physics. 2/17/2021, Vol. 4 Issue 1, p1-8. 8p.
Akademický článek
Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.
K zobrazení výsledku je třeba se přihlásit.