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Jozsef Csontos
Jozsef Csontos
在 mail.bme.hu 的电子邮件经过验证 - 首页
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引用次数
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The MRCC program system: Accurate quantum chemistry from water to proteins
M Kállay, PR Nagy, D Mester, Z Rolik, G Samu, J Csontos, J Csóka, ...
The Journal of chemical physics 152 (7), 2020
3352020
MRCC, a quantum chemical program suite
M Kállay, Z Rolik, J Csontos, I Ladjánszki, L Szegedy, B Ladóczki, ...
URL: http://www. mrcc. hu, accessed August 26th 56, 2016
2772016
Optimization of diagnostic microarray for application in analysing landfill methanotroph communities under different plant covers
N StralisPavese, A Sessitsch, A Weilharter, T Reichenauer, J Riesing, ...
Environmental Microbiology 6 (4), 347-363, 2004
2332004
High-accuracy thermochemistry of atmospherically important fluorinated and chlorinated methane derivatives
J Csontos, Z Rolik, S Das, M Kallay
The Journal of Physical Chemistry A 114 (50), 13093-13103, 2010
1002010
Enumeration of the conformers of unbranched aliphatic alkanes
G Tasi, F Mizukami, I Pálinkó, J Csontos, W Győrffy, P Nair, K Maeda, ...
The Journal of Physical Chemistry A 102 (39), 7698-7703, 1998
591998
On the protonation of water
A Bodi, J Csontos, M Kállay, S Borkar, B Sztáray
Chemical Science 5 (8), 3057-3063, 2014
462014
High-Throughput Analysis of Ammonia Oxidiser Community Composition via a Novel, amoA-Based Functional Gene Array
GCJ Abell, SS Robert, DMF Frampton, JK Volkman, F Rizwi, J Csontos, ...
PloS one 7 (12), e51542, 2012
412012
Aromaticbackbone interactions in model αhelical peptides
NY Palermo, J Csontos, MC Owen, RF Murphy, S Lovas
Journal of Computational Chemistry 28 (7), 1208-1214, 2007
402007
High-accuracy theoretical thermochemistry of atmospherically important sulfur-containing molecules
B Nagy, P Szakács, J Csontos, Z Rolik, G Tasi, M Kállay
The Journal of Physical Chemistry A 115 (26), 7823-7833, 2011
392011
Calculation of weakly polar interaction energies in polypeptides using density functional and local MøllerPlesset perturbation theory
J Csontos, NY Palermo, RF Murphy, S Lovas
Journal of computational chemistry 29 (8), 1344-1352, 2008
362008
MRCC, a quantum chemical program suite. 2018
M Kállay, PR Nagy, Z Rolik, D Mester, G Samu, J Csontos, J Csóka, ...
For the current version, see: http://www. mrcc. hu, 2019
342019
High-accuracy theoretical thermochemistry of fluoroethanes
B Nagy, B Csontos, J Csontos, P Szakács, M Kállay
The Journal of Physical Chemistry A 118 (26), 4824-4836, 2014
332014
Quantum algebraic–combinatoric study of the conformational properties of n-alkanes. II
G Tasi, F Mizukami, J Csontos, W Győrffy, I Pálinkó
Journal of Mathematical Chemistry 27, 191-199, 2000
322000
High-accuracy theoretical thermochemistry of atmospherically important nitrogen oxide derivatives
P Szakács, J Csontos, S Das, M Kállay
The Journal of Physical Chemistry A 115 (14), 3144-3153, 2011
302011
Moderate-Cost Ab Initio Thermochemistry with Chemical Accuracy
Á Ganyecz, M Kállay, J Csontos
Journal of Chemical Theory and Computation 13 (9), 4193-4204, 2017
272017
High-accuracy theoretical study on the thermochemistry of several formaldehyde derivatives
B Nagy, J Csontos, M Kallay, G Tasi
The Journal of Physical Chemistry A 114 (50), 13213-13221, 2010
262010
High accuracy quantum chemical and thermochemical network data for the heats of formation of fluorinated and chlorinated methanes and ethanes
Á Ganyecz, M Kállay, J Csontos
The Journal of Physical Chemistry A 122 (28), 5993-6006, 2018
252018
Dissociation of the fluorine molecule
B Csontos, B Nagy, J Csontos, M Kállay
The Journal of Physical Chemistry A 117 (26), 5518-5528, 2013
252013
Benchmarking experimental and computational thermochemical data: a case study of the butane conformers
D Barna, B Nagy, J Csontos, AG Császár, G Tasi
Journal of Chemical Theory and Computation 8 (2), 479-486, 2012
242012
Quantum chemical quantification of weakly polar interaction energies in the TC5b miniprotein
MPD Hatfield, NY Palermo, J Csontos, RF Murphy, S Lovas
The Journal of Physical Chemistry B 112 (11), 3503-3508, 2008
202008
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