Amit Samanta
Cited by
Cited by
Temperature and strain-rate dependence of surface dislocation nucleation
T Zhu, J Li, A Samanta, A Leach, K Gall
Physical Review Letters 100 (2), 025502, 2008
Interfacial plasticity governs strain rate sensitivity and ductility in nanostructured metals
T Zhu, J Li, A Samanta, HG Kim, S Suresh
Proceedings of the National Academy of Sciences 104 (9), 3031-3036, 2007
Theoretical assessment of the elastic constants and hydrogen storage capacity of some metal-organic framework materials
A Samanta, T Furuta, J Li
The Journal of chemical physics 125 (8), 084714, 2006
Predicting phase behavior of grain boundaries with evolutionary search and machine learning
Q Zhu, A Samanta, B Li, RE Rudd, T Frolov
Nature communications 9 (1), 1-9, 2018
Microscopic mechanisms of equilibrium melting of a solid
A Samanta, ME Tuckerman, TQ Yu, W E
Science 346, 729-732, 2014
Atomic and electronic structures of single-layer FeSe on SrTiO(001): The role of oxygen deficiency
J Bang, Z Li, YY Sun, A Samanta, YY Zhang, W Zhang, L Wang, X Chen, ...
Physical Review B 87 (22), 220503, 2013
Solvation and dynamics of sodium and potassium in ethylene carbonate from ab initio molecular dynamics simulations
TA Pham, KE Kweon, A Samanta, V Lordi, JE Pask
The Journal of Physical Chemistry C 121 (40), 21913-21920, 2017
Order-parameter-aided temperature-accelerated sampling for the exploration of crystal polymorphism and solid-liquid phase transitions
TQ Yu, PY Chen, M Chen, A Samanta, E Vanden-Eijnden, M Tuckerman
The Journal of chemical physics 140 (21), 06B603_1, 2014
In situ TEM observation of FCC Ti formation at elevated temperatures
Q Yu, J Kacher, C Gammer, R Traylor, A Samanta, Z Yang, AM Minor
Scripta Materialia 140, 9-12, 2017
Atomistic simulations of rare events using gentlest ascent dynamics
A Samanta, W E
The Journal of chemical physics 136 (12), 124104, 2012
Recent developments in computational modelling of nucleation in phase transformations
L Zhang, W Ren, A Samanta, Q Du
NPJ Computational Materials 2 (1), 1-9, 2016
Method for defect stability diagram from ab initio calculations: A case study of SrTiO 3
A Samanta, E Weinan, SB Zhang
Physical Review B 86 (19), 195107, 2012
Optimization-based string method for finding minimum energy path
A Samanta, E Weinan
Communications in Computational Physics 14 (2), 265-275, 2013
Descriptor-Based Approach for the Prediction of Cation Vacancy Formation Energies and Transition Levels
A Samanta, JB Varley, V Lordi
J. Phys. Chem. Lett. 8 (20), 5059, 2017
Dislocation mediated alignment during metal nanoparticle coalescence
AP Lange, A Samanta, H Majidi, S Mahajan, J Ging, TY Olson, ...
Acta Materialia 120, 364-378, 2016
Sampling saddle points on a free energy surface
A Samanta, M Chen, TQ Yu, M Tuckerman, W E
The Journal of chemical physics 140 (16), 04B610_1, 2014
Difficulty in predicting shallow defects with hybrid functionals: implication of the long-range exchange interaction
J Bang, YY Sun, TA Abtew, A Samanta, P Zhang, SB Zhang
Physical Review B 88 (3), 035134, 2013
Exploring the free energy surface using ab initio molecular dynamics
A Samanta, MA Morales, E Schwegler
The Journal of chemical physics 144 (16), 164101, 2016
Extraction of effective solid-liquid interfacial free energies for full 3D solid crystallites from equilibrium MD simulations
LA Zepeda-Ruiza, B Sadigh, AA Chernov, T Haxhimali, A Samanta, ...
Journal of Chemical Physics 147, 194704, 2017
Fluid like behavior of oxygen in cubic zirconia under extreme conditions
A Samanta, SB Zhang
Applied Physics Letters 101 (18), 181906, 2012
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