Professor Gabor Csanyi

Professor

Publications

Machine learning for predictive condensed-phase simulation

AP Bartok, MJ Gillan, FR Manby, G Csanyi

(2013)

Machine learning for predictive condensed-phase simulation

AP Bartok, MJ Gillan, FR Manby, G Csanyi

(2013)

(doi: 10.48550/arxiv.1302.5680)

Topologically invariant reaction coordinates for simulating multistate chemical reactions

L Mones, G Csányi

Journal of Physical Chemistry B

(2012)

116

14876

(doi: 10.1021/jp307648s)

Nonsmooth geometry and collapse of flexible structures under smooth loads

G Csanyi, G Domokos

(2012)

QM/MM simulation of liquid water with an adaptive quantum region.

N Bernstein, C Várnai, I Solt, SA Winfield, MC Payne, I Simon, M Fuxreiter, G Csányi

Physical Chemistry Chemical Physics

(2011)

646

(doi: 10.1039/c1cp22600b)

Reply to “Comment on 'Dynamic Catalyst Restructuring during Carbon Nanotube Growth'”

M Moseler, F Cervantes-Sodi, A Klemenz, S Hofmann, G Csanyi, AC Ferrari

ACS Nano

(2011)

686

(doi: 10.1021/nn200218k)

Dynamic catalyst restructuring during carbon nanotube growth.

M Michael, C-S Felipe, H Stephan, C Gabor, F Andrea C

ACS Nano

(2010)

7587

(doi: 10.1021/nn102118y)

Viscous state effect on the activity of Fe nanocatalysts.

F Cervantes-Sodi, TP McNicholas, JG Simmons, J Liu, G Csányi, AC Ferrari, S Curtarolo

ACS Nano

(2010)

6950

(doi: 10.1021/nn101883s)

Diffusive nested sampling

BJ Brewer, LB Pártay, G Csányi

STATISTICS AND COMPUTING

(2010)

649

(doi: 10.1007/s11222-010-9198-8)

Efficient sampling of atomic configurational spaces.

LB Pártay, AP Bartók, G Csányi

Journal of Physical Chemistry B

(2010)

114

10502

(doi: 10.1021/jp1012973)

Professor Gabor Csanyi

Professor

Publications

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Study at Cambridge

About the University

Research at Cambridge