Items where Author is "Rolik, Zoltán"

Article

Kállay, Mihály and Nagy, Péter R. and Mester, Dávid and Rolik, Zoltán and Samu, Gyula and Csontos, József and Csóka, József and Szabó, P. Bernát and Gyevi-Nagy, László and Hégely, Bence and Ladjánszki, István and Szegedy, Lóránt and Ladóczki, Bence and Petrov, Klára and Farkas, Máté and Mezei, Pál D. and Ganyecz, Ádám (2020) The MRCC program system: Accurate quantum chemistry from water to proteins. JOURNAL OF CHEMICAL PHYSICS, 152 (7). 074107. ISSN 0021-9606

Rolik, Zoltán and Kállay, Mihály (2018) Novel strategy to implement active-space coupled-cluster methods. JOURNAL OF CHEMICAL PHYSICS, 148. pp. 1-17. ISSN 0021-9606

Rolik, Zoltán and Szegedy, Lóránt and Ladjanszki, István and Ladoczki, Bence and Kállay, Mihály (2013) An efficient linear-scaling CCSD(T) method based on local natural orbitals. JOURNAL OF CHEMICAL PHYSICS, 139 (9). 094105/1-17. ISSN 0021-9606

Rolik, Zoltán and Kállay, Mihály (2011) A general-order local coupled-cluster method based on the cluster-in-molecule approach. JOURNAL OF CHEMICAL PHYSICS, 135 (10). pp. 1-18. ISSN 0021-9606

Csontos, József and Rolik, Zoltán and Das, Sanghamitra and Kállay, Mihály (2010) High-Accuracy Thermochemistry of Atmospherically Important Fluorinated and Chlorinated Methane Derivatives. JOURNAL OF PHYSICAL CHEMISTRY A, 114 (50). pp. 13093-13103. ISSN 1089-5639

Monograph

Surján, Péter and Kállay, Mihály and Kohalmi, Dóra and Rolik, Zoltán and Szabados, Ágnes and Tóth, Gábor (2009) Modellek a kvantumkémiában = Models in Quantum Chemistry. Project Report. OTKA.