Gábor Csányi
发表
Gábor Csányi,
Matthew D. Segall,
Olga Obrezanova,
2007,
J. Chem. Inf. Model..
R. Kondor,
M. Payne,
Gábor Csányi,
2009,
Physical review letters.
R. Kondor,
Gábor Csányi,
A. P. Bart'ok,
2012,
1209.3140.
Gábor Csányi,
A. Bartók,
M. Ceriotti,
2015,
Physical chemistry chemical physics : PCCP.
Gábor Csányi,
A. Bartók,
2015,
1502.01366.
Volker L. Deringer,
S. Elliott,
T. Laurila,
2018,
Chemistry of Materials.
Michael J. Willatt,
Gábor Csányi,
M. Ceriotti,
2020
.
Gábor Csányi,
D. Cole,
L. Mones,
2020,
Faraday discussions.
Gábor Csányi,
M. Ceriotti,
Chiheb Ben Mahmoud,
2020,
2006.11803.
Gábor Csányi,
M. Finnis,
E. R. M. Davidson,
2020
.
Gábor Csányi,
Yuanbin Liu,
Jia-yue Yang,
2020,
The Journal of chemical physics.
Cas van der Oord,
Gábor Csányi,
G. Dusson,
2019,
Mach. Learn. Sci. Technol..
Volker L. Deringer,
Gábor Csányi,
M. Caro,
2020,
Nature Communications.
J. Behler,
Z. Deng,
Chi Chen,
2019,
The journal of physical chemistry. A.
Conrad W. Rosenbrock,
Tim Mueller,
Matthias Rupp,
2018,
npj Computational Materials.
Volker L. Deringer,
Gábor Csányi,
M. Caro,
2019,
Advanced materials.
Jun Cheng,
Volker L. Deringer,
Gábor Csányi,
2019,
Journal of Materials Chemistry A.
Michele Ceriotti,
Michael J. Willatt,
G'abor Cs'anyi,
2019,
Handbook of Materials Modeling.
Noam Bernstein,
Volker L. Deringer,
Gábor Csányi,
2019,
npj Computational Materials.
Noam Bernstein,
Gabor Csanyi,
James Kermode,
2018,
Physical Review X.
Gábor Csányi,
Dario Alfè,
Angelos Michaelides,
2017,
1710.04187.
Volker L. Deringer,
S. Elliott,
Gábor Csányi,
2017,
The Journal of chemical physics.
Jörg Behler,
Michele Ceriotti,
Gábor Csányi,
2018,
The Journal of chemical physics.
Volker L. Deringer,
Gábor Csányi,
Stephen R. Elliott,
2018
.
Noam Bernstein,
Volker L. Deringer,
Gábor Csányi,
2018,
The journal of physical chemistry letters.
Gabor Csanyi,
Nicola Marzari,
Daniele Dragoni,
2017,
1706.10229.
Volker L. Deringer,
Gábor Csányi,
Volker L Deringer,
2018,
The journal of physical chemistry letters.
George H. Booth,
A. Glielmo,
Gábor Csányi,
2020,
Physical Review X.
Johannes T. Margraf,
Volker L. Deringer,
Gábor Csányi,
2020,
Accounts of chemical research.
M. Payne,
J. Robertson,
Gábor Csányi,
2005,
Physical review letters.
Gábor Csányi,
B. Szendrői,
Balázs Szendrői,
2003,
Physical review. E, Statistical, nonlinear, and soft matter physics.
Volker L. Deringer,
S. Elliott,
David Alan Drabold,
2019,
1912.07344.
M. Payne,
Gábor Csányi,
A. P. Bart'ok,
2015,
1503.03404.
Gábor Csányi,
N. Bernstein,
R. Baldock,
2017,
Physical review. E.
Gábor Csányi,
S. T. John,
Gábor Csányi,
2016,
The journal of physical chemistry. B.
Volker L. Deringer,
Gábor Csányi,
Volker L Deringer,
2017,
Physical review letters.
Tomi Laurila,
Volker L. Deringer,
Gábor Csányi,
2018,
Chemistry of materials : a publication of the American Chemical Society.
Gábor Csányi,
Albert P. Bartók,
Gábor Csányi,
2014
.
Volker L. Deringer,
G'abor Cs'anyi,
Gábor Csányi,
2016,
1611.03277.
R. Kondor,
T. Jebara,
S. Ahnert,
2005
.
Gábor Csányi,
S. Piscanec,
A. Ferrari,
2007,
Physical Review B.
Z. Fisk,
L. Balicas,
Gábor Csányi,
2008,
Physical review letters.
Gábor Csányi,
Balázs Szendroi,
Gábor Csányi,
2004,
Physical review. E, Statistical, nonlinear, and soft matter physics.
Gábor Csányi,
K. Rossi,
F. Baletto,
2018,
Scientific Reports.
Noam Bernstein,
Gábor Csányi,
James R. Kermode,
2009
.
Gábor Csányi,
Albert P Bartók,
Lívia B Pártay,
2012,
Physical review. E, Statistical, nonlinear, and soft matter physics.
Gábor Csányi,
J. Kertész,
Gábor Csányi,
1995
.
Gábor Csányi,
A. Bartók,
C. Pickard,
2017,
Physical Chemistry, Chemical Physics - PCCP.
M. Payne,
Gábor Csányi,
J. Kermode,
2007
.
Gábor Csányi,
K. Reuter,
J. T. Margraf,
2020,
Nature Communications.
Gábor Csányi,
A. P. Bart'ok,
D. Alfé,
2013,
1303.0751.
M. Payne,
Gábor Csányi,
C. Várnai,
2020,
Physical chemistry chemical physics : PCCP.
S. Garaj,
Gábor Csányi,
L. Forró,
2005
.
Michael J. Willatt,
Gábor Csányi,
S. Pozdnyakov,
2022,
Journal of Chemical Physics.
An Experimentally Driven Automated Machine Learned lnter-Atomic Potential for a Refractory Oxide
pdf
Chris J. Benmore,
Ganesh Sivaraman,
Leighanne Gallington,
2020,
Physical review letters.
R. Drautz,
Gábor Csányi,
B. Kozinsky,
2022,
2205.06643.
David L. Wild,
Robert J. N. Baldock,
Gábor Csányi,
2016,
Comput. Phys. Commun..
Gábor Csányi,
C. Ortner,
G. Simm,
2022,
2206.07697.
Leah F. South,
M. Habeck,
D. Wales,
2022,
Nature Reviews Methods Primers.
Leah F. South,
M. Habeck,
D. Wales,
2022,
Nature Reviews Methods Primers.
Johannes T. Margraf,
Gábor Csányi,
K. Reuter,
2022,
Journal of chemical theory and computation.
Graphite intercalation compounds under pressure : A first-principles density functional theory study
R. Needs,
Gábor Csányi,
C. Pickard,
2007
.
Gábor Csányi,
A. Bartók,
D. Alfé,
2013,
The Journal of chemical physics.
M. Payne,
Gábor Csányi,
J. Kermode,
2007
.
M. Payne,
Gábor Csányi,
J. Kermode,
2010
.
Gábor Csányi,
D. Cole,
L. Mones,
2019,
Faraday discussions.
T. Arias,
Gábor Csányi,
S. Ismail-Beigi,
2000,
cond-mat/0011147.
Conrad W. Rosenbrock,
M. Rupp,
D. Wingate,
2018,
1809.09203.
Volker L. Deringer,
T. Laurila,
Gábor Csányi,
2020,
Physical Review B.
Volker L. Deringer,
T. Laurila,
Gábor Csányi,
2020
.
Gábor Csányi,
E. Giessen,
Lei Zhang,
2022,
npj Computational Materials.
A. Laio,
Gábor Csányi,
Bing Cheng,
2021,
PNAS nexus.
B. Oborny,
Gábor Csányi,
G. Meszéna,
2009
.
Gábor Csányi,
T. Zalewska,
M. Gajda,
2012
.
T. Arias,
Gábor Csányi,
2002,
Chemical Physics Letters.
Cas van der Oord,
Gábor Csányi,
C. Ortner,
2022
.
James P. Darby,
Gábor Csányi,
G. Hart,
2022,
ArXiv.
Gábor Csányi,
C. Ortner,
G. Simm,
2022,
ArXiv.
Ian T. Foster,
Gábor Csányi,
Á. Vázquez-Mayagoitia,
2022,
Journal of the Physical Society of Japan.
M. Payne,
Gábor Csányi,
A. Nevidomskyy,
2003,
Physical review letters.
Gábor Csányi,
N. Bernstein,
L. Pártay,
2021
.
Johannes T. Margraf,
Gábor Csányi,
K. Reuter,
2021,
ACS Applied Energy Materials.
Michael J. Willatt,
Gábor Csányi,
S. Pozdnyakov,
2022,
Journal of Chemical Physics.
T. Arias,
Gábor Csányi,
S. Ismail-Beigi,
1998,
cond-mat/9805328.
Cas van der Oord,
Gábor Csányi,
C. Ortner,
2022,
npj computational materials.
Simon L. Batzner,
R. Drautz,
Gábor Csányi,
2022,
ArXiv.
James P. Darby,
Gábor Csányi,
J. Kermode,
2021,
npj Computational Materials.
Andrea Grisafi,
Michele Ceriotti,
Gábor Csányi,
2017,
Physical review letters.
C. Grey,
Gábor Csányi,
A. P. Bart'ok,
2016,
1609.00668.
James P. Darby,
Gábor Csányi,
G. Hart,
2022,
Physical review letters.
S. S. Shishvan,
Gábor Csányi,
V. Deshpande,
2020,
Journal of the Mechanics and Physics of Solids.
D. Vrbanic,
D. Mihailovic,
Gábor Csányi,
2007,
Small.
Conrad W. Rosenbrock,
Gus L. W. Hart,
Noam Bernstein,
2019,
npj Computational Materials.
Gábor Csányi,
Kjartan Thor Wikfeldt,
Valeria Molinero,
2016,
Chemical reviews.
Johannes T. Margraf,
Gábor Csányi,
K. Reuter,
2021,
Chemical science.
Stefano Curtarolo,
Gabor Csányi,
Gábor Csányi,
2010,
ACS nano.
W Benoit,
G Csányi,
Gábor Csányi,
2004,
Nature materials.
Z. Fisk,
L. Balicas,
Gábor Csányi,
2009
.
Eric R. Homer,
Conrad W. Rosenbrock,
Gus L. W. Hart,
2017,
npj Computational Materials.
M. Szente,
Gábor Csányi,
L. Vécsei,
2008,
Pharmacological reports : PR.
M. Berecibar,
Gábor Csányi,
A. Bhowmik,
2021,
Advanced Energy Materials.
Gábor Csányi,
M. Ceriotti,
A. P. Bart'ok,
2021,
Chemical reviews.
Volker L. Deringer,
David Alan Drabold,
Gábor Csányi,
2021,
Nature.
Gábor Csányi,
D. Alfé,
Jin Liu,
2022,
Geophysical Research Letters.
Cas van der Oord,
R. Drautz,
Aidan Thompson,
2021,
npj Computational Materials.
Volker L. Deringer,
Gábor Csányi,
A. Bartók,
2021,
Chemical reviews.
Noam Bernstein,
James R Kermode,
Michele Ceriotti,
2017,
Science Advances.
Noam Bernstein,
Gábor Csányi,
Letif Mones,
2016,
Journal of chemical theory and computation.
Gábor Csányi,
Á. Vázquez-Mayagoitia,
C. Benmore,
2020,
npj Computational Materials.
P. Littlewood,
Gábor Csányi,
C. Pickard,
2005
.
Michael J. Willatt,
Gábor Csányi,
A. Bartók,
2023,
ArXiv.
Cas van der Oord,
R. Drautz,
Gábor Csányi,
2019,
J. Comput. Phys..
Yuchen Hu,
Volker L. Deringer,
Gábor Csányi,
2018,
Chemical communications.
Leah F. South,
M. Habeck,
D. Wales,
2022,
Nature Reviews Methods Primers.
Gábor Csányi,
Alexey Dral,
Pavlo O. Dral,
2020,
The Journal of chemical physics.
Brendon J. Brewer,
Gábor Csányi,
Lívia B. Pártay,
2009,
Stat. Comput..
Jörg Behler,
Gábor Csányi,
J. Behler,
2021,
The European Physical Journal B.
Noam Bernstein,
Volker L. Deringer,
Gábor Csányi,
2018,
The journal of physical chemistry. B.
Alexander L. Shluger,
Vasily V. Bulatov,
Alejandro Strachan,
2020,
Modelling and Simulation in Materials Science and Engineering.
Gábor Csányi,
D. Alfé,
Zhigang Zhang,
2020,
Geochimica et Cosmochimica Acta.
T. Arias,
Gábor Csányi,
1998,
cond-mat/9805388.
Gábor Csányi,
S. Piscanec,
A. Ferrari,
2008
.
Gábor Csányi,
A. Bartók,
D. Alfé,
2014,
The Journal of chemical physics.
Frederick R. Manby,
Gábor Csányi,
M. J. Gillan,
2013
.
T. Arias,
S. Goedecker,
Gábor Csányi,
2001,
cond-mat/0107536.
P. Gumbsch,
A. De Vita,
M. Payne,
2008,
Nature.
Noam Bernstein,
Gábor Csányi,
Alessandro De Vita,
2007
.
Gábor Csányi,
L. Forró,
M. Ellerby,
2007
.
Volker L. Deringer,
A. Michaelides,
Gábor Csányi,
2020,
The Journal of chemical physics.
N. Baena,
G. Antiñolo,
Gábor Csányi,
2017,
Scientific Reports.
Gábor Csányi,
C. Ortner,
G. Simm,
2022,
NeurIPS.
Gábor Csányi,
S. Pozdnyakov,
M. Ceriotti,
2021,
Open research Europe.
Christoph Ortner,
Michele Ceriotti,
Sergey N. Pozdnyakov,
2020,
Physical review letters.
Johannes T. Margraf,
Gábor Csányi,
K. Reuter,
2021,
Mach. Learn. Sci. Technol..
Gábor Csányi,
Edvin Fako,
L. Schaaf,
2023,
2301.09931.
R. Drautz,
Gábor Csányi,
C. Ortner,
2022,
Physical Review Research.
Cas van der Oord,
Gábor Csányi,
D. Cole,
2021,
Journal of chemical theory and computation.
Gábor Csányi,
C. Ortner,
D. P. Kovács,
2021
.
Cas van der Oord,
Gábor Csányi,
D. Cole,
2021,
Journal of chemical theory and computation.
Volker L. Deringer,
G. Hautier,
Gábor Csányi,
2020,
The Journal of chemical physics.
Jos'e Miguel Hern'andez-Lobato,
José Miguel Hernández-Lobato,
Gregor N. C. Simm,
2020,
ICLR.
Volker L. Deringer,
T. Laurila,
Gábor Csányi,
2018,
Physical review letters.
Volker L. Deringer,
Gábor Csányi,
D. Proserpio,
2017,
Chemphyschem : a European journal of chemical physics and physical chemistry.
P. Littlewood,
Gábor Csányi,
C. Pickard,
2005,
cond-mat/0503569.
Andrew Jones,
Noam Bernstein,
Andreas W. Götz,
2014,
J. Comput. Chem..
Gábor Csányi,
D. Pontiroli,
M. Riccò,
2009,
Physical review letters.
Gábor Csányi,
A. Ferrari,
M. Moseler,
2010,
ACS nano.
Christoph Ortner,
Gábor Csányi,
Geneviève Dusson,
2020,
Mach. Learn. Sci. Technol..
Petr Kulhánek,
István Simon,
Monika Fuxreiter,
2009,
The journal of physical chemistry. B.
Noam Bernstein,
Volker L. Deringer,
Gábor Csányi,
2018,
Angewandte Chemie.
S. Goodnick,
Gábor Csányi,
Reza Vatan Meidanshahi,
2021,
Physical Review Materials.
T. Ala‐Nissila,
Gábor Csányi,
A. P. Bart'ok,
2021,
Physical Review B.
Noam Bernstein,
Volker L. Deringer,
Stephen R. Elliott,
2018,
1811.11069.
M C Payne,
Gabor Csányi,
T Albaret,
2004,
Physical review letters.
Gábor Csányi,
C. Ortner,
D. P. Kovács,
2021
.
Gábor Csányi,
Ilyes Batatia,
D. P. Kovács,
2023,
2305.14247.
Noam Bernstein,
Gábor Csányi,
Thomas Stecher,
2013,
Journal of chemical theory and computation.
J. Nagy,
Gábor Csányi,
F. Béguin,
2005
.
Andrea Vigliotti,
Gábor Csányi,
Vikram Deshpande,
2018,
Journal of the Mechanics and Physics of Solids.
M. Payne,
Gábor Csányi,
M. ElGamacy,
2015
.
Noam Bernstein,
Christoph Ortner,
Nicholas Gould,
2016,
The Journal of chemical physics.
Christoph Ortner,
Gábor Csányi,
Letif Mones,
2018,
Scientific Reports.
Modelling (100) hydrogen-induced platelets in silicon with a multi-scale molecular dynamics approach
Gábor Csányi,
L. Ciacchi,
G. Moras,
2007
.
M. Payne,
Gábor Csányi,
G. Moras,
2006
.
A. Walsh,
Gábor Csányi,
C. Sutton,
2023,
Small.
Gábor Csányi,
D. Hohl,
M. Veit,
2018,
Journal of chemical theory and computation.
Volker L. Deringer,
Gábor Csányi,
2016
.
Volker L. Deringer,
Gábor Csányi,
Volker L Deringer,
2018,
Faraday discussions.
Gábor Csányi,
Letif Mones,
Gábor Csányi,
2012,
The journal of physical chemistry. B.
William A. Curtin,
Nicola Marzari,
Daniele Dragoni,
2018,
npj Computational Materials.
Noam Bernstein,
Gábor Csányi,
Letif Mones,
2013,
The journal of physical chemistry. B.
P. Bolhuis,
Gábor Csányi,
2018
.
Gábor Csányi,
K. Reuter,
N. Bernstein,
2023,
2306.11421.
Gábor Csányi,
Ilyes Batatia,
D. P. Kovács,
2023,
The Journal of chemical physics.
Gábor Csányi,
Zhenzhu Li,
J. Klarbring,
2023,
2305.11617.
Markus Bachmayr,
Gabor Csanyi,
Genevieve Dusson,
2019,
ArXiv.
Gábor Csányi,
Gábor Csányi,
2005
.
Gábor Csányi,
N. Bernstein,
L. Pártay,
2021,
The European Physical Journal B.
Volker L. Deringer,
David Alan Drabold,
Gábor Csányi,
2021,
Nature.
Machine Learning Inter-Atomic Potentials Generation Driven by Active Learning: A Case Study for Amorphous and Liquid Hafnium dioxide
pdf
Álvaro Vázquez-Mayagoitia,
Marius Stan,
Ganesh Sivaraman,
2019,
ArXiv.
Risi Kondor,
Gábor Csányi,
Albert P. Bartók,
2013
.
Gábor Csányi,
A. Bartók,
D. Alfé,
2013,
The Journal of chemical physics.
Gábor Csányi,
J. Maillet,
C. Denoual,
2018
.
Gábor Csányi,
Daniel J Cole,
Mike C Payne,
2007,
The Journal of chemical physics.
Gábor Csányi,
Mike C. Payne,
James R. Kermode,
2009
.
Gábor Csányi,
E. Giessen,
F. Maresca,
2023
.
S. S. Shishvan,
Gábor Csányi,
V. S. Deshpande,
2023,
Acta Materialia.
Cas van der Oord,
A. Thompson,
R. Drautz,
2021
.
Gábor Csányi,
J. Lischner,
Stefano Dal Forno,
2021,
Mach. Learn. Sci. Technol..
Gábor Csányi,
K. Reuter,
N. Bernstein,
2023,
The Journal of chemical physics.
S. Garaj,
Gábor Csányi,
L. Forró,
2005,
Physical review letters.
Peter G. Bolhuis,
Gábor Csányi,
P. Bolhuis,
2018,
Physical review letters.
Gábor Csányi,
Zhenzhu Li,
J. Klarbring,
2023,
The journal of physical chemistry. C, Nanomaterials and interfaces.
Gábor Csányi,
J. W. Morgan,
David J Wales,
2023,
The Journal of chemical physics.
Michael J. Willatt,
Gábor Csányi,
A. Bartók,
2023,
APL Machine Learning.
Gábor Csányi,
J. Sullivan,
B. Marshall,
2023,
Function.
J. Behler,
Z. Deng,
Chi Chen,
2019,
The journal of physical chemistry. A.
Gábor Csányi,
Albert P Bartók,
Lívia B Pártay,
2009,
The journal of physical chemistry. B.
Volker L. Deringer,
Lauren E. Marbella,
C. Grey,
2018,
The journal of physical chemistry letters.
Volker L. Deringer,
Gábor Csányi,
A. Bartók,
2023,
The Journal of chemical physics.
Gábor Csányi,
Á. Vázquez-Mayagoitia,
C. Benmore,
2021,
Physical review letters.
Gábor Csányi,
N. Bernstein,
R. Baldock,
2017,
Physical review. E.
A. Michaelides,
Gábor Csányi,
V. Kapil,
2023,
Faraday discussions.
C. Grey,
Gábor Csányi,
K. Hermansson,
2023,
npj Computational Materials.
Gábor Csányi,
A. P. Bart'ok,
W. J. Szlachta,
2014,
1405.4370.
J. Behler,
Gábor Csányi,
M. Ceriotti,
2018,
The Journal of chemical physics.
Michael J. Willatt,
Gábor Csányi,
A. Bartók,
2020,
2001.11696.
P. Littlewood,
Gábor Csányi,
C. Pickard,
2005,
cond-mat/0503569.
Mike C. Payne,
Gábor Csányi,
T Albaret,
2005
.
Gábor Csányi,
Balázs Szendroi,
Gábor Csányi,
2004,
Proceedings of the Royal Society of London. Series B: Biological Sciences.
Gábor Csányi,
J. Kermode,
A. Bartók,
2017,
Science Advances.
Johannes T. Margraf,
Gábor Csányi,
K. Reuter,
2020,
Nature Communications.
Noam Bernstein,
István Simon,
Gábor Csányi,
2012,
Physical chemistry chemical physics : PCCP.
Cas van der Oord,
Gábor Csányi,
J. Kermode,
2023,
The Journal of chemical physics.