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Representing local atomic environment using descriptors based on local correlations

The Journal of chemical physics, 2018-12, Vol.149 (24), p.244102-244102

Samanta, Amit

2018

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Melting point of iron at high pressure: An assessment of uncertainties and effect of electronic temperature

Applied physics letters, 2024-04, Vol.124 (14)

2024

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New insights on cellular structures strengthening mechanisms and thermal stability of an austenitic stainless steel fabricated by laser powder-bed-fusion

Acta materialia, 2021-01, Vol.203 (C), p.116476, Article 116476

2021

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Predicting phase behavior of grain boundaries with evolutionary search and machine learning

Nature communications, 2018-02, Vol.9 (1), p.467-9, Article 467

2018

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High pressure melt line of nickel using a generalized embedded atomic method potential

Applied physics letters, 2024-06, Vol.124 (23)

2024

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Solvation and Dynamics of Sodium and Potassium in Ethylene Carbonate from ab Initio Molecular Dynamics Simulations

Journal of physical chemistry. C, 2017-10, Vol.121 (40), p.21913-21920

2017

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Temperature and strain-rate dependence of surface dislocation nucleation

Physical review letters, 2008-01, Vol.100 (2), p.025502-025502, Article 025502

2008

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Analysis of defects in In2O3:H synthesized in presence of water vapor and hydrogen gas mixture

Journal of applied physics, 2021-01, Vol.129 (4)

2021

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The thermodynamics of a liquid-solid interface at extreme conditions: A model close-packed system up to 100 GPa

The Journal of chemical physics, 2018-09, Vol.149 (12), p.124703-124703

2018

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Energetics and Predissociation Dynamics of Small Water, HCl, and Mixed HCl–Water Clusters

Chemical reviews, 2016-05, Vol.116 (9), p.4913-4936

2016

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The role of water vapor during the synthesis of hydrogen doped In2O3

Applied physics letters, 2020-08, Vol.117 (6)

2020

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In situ TEM observation of FCC Ti formation at elevated temperatures

Scripta materialia, 2017-11, Vol.140 (C), p.9-12

2017

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Interfacial plasticity governs strain rate sensitivity and ductility in nanostructured metals

Proceedings of the National Academy of Sciences - PNAS, 2007-02, Vol.104 (9), p.3031-3036

2007

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Time-Resolved Single-Particle X‑ray Scattering Reveals Electron-Density Gradients As Coherent Plasmonic-Nanoparticle-Oscillation Source

Nano letters, 2023-07, Vol.23 (13), p.5943-5950

2023

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Microscopic mechanisms of equilibrium melting of a solid

Science (American Association for the Advancement of Science), 2014-11, Vol.346 (6210), p.729-732

2014

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Accurate parameterization of the kinetic energy functional

The Journal of chemical physics, 2022-01, Vol.156 (2), p.024110-024110

2022

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Accurate parameterization of the kinetic energy functional for calculations using exact-exchange

The Journal of chemical physics, 2022-01, Vol.156 (2), p.024107-024107

2022

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Atomistic simulations of rare events using gentlest ascent dynamics

The Journal of chemical physics, 2012-03, Vol.136 (12), p.124104-124104-11

2012

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Experimental and Theoretical Investigations of Energy Transfer and Hydrogen-Bond Breaking in the Water Dimer

Journal of the American Chemical Society, 2012-09, Vol.134 (37), p.15430-15435

2012

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Experimental and Theoretical Investigations of Energy Transfer and Hydrogen-Bond Breaking in Small Water and HCl Clusters

Accounts of chemical research, 2014-08, Vol.47 (8), p.2700-2709

2014

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Temperature-Dependent Configurational Entropy Calculations for Refractory High-Entropy Alloys

Journal of phase equilibria and diffusion, 2021-10, Vol.42 (5), p.571-577

2021

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Exploring the free energy surface using ab initio molecular dynamics

The Journal of chemical physics, 2016-04, Vol.144 (16), p.164101-164101

2016

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Light-sheet imaging for the recording of transverse absolute density distributions of gas-phase particle-beams from nanoparticle injectors

Optics express, 2019-12, Vol.27 (25), p.36580-36586

2019

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On Low Latency Uplink Scheduling for Cellular Haptic Communication to Support Tactile Internet

Wireless personal communications, 2021-12, Vol.121 (3), p.1471-1488

2021

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Optimizing the geometry of aerodynamic lens injectors for single‐particle coherent diffractive imaging of gold nanoparticles

Journal of applied crystallography, 2021-12, Vol.54 (6), p.1730-1737

2021

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Representing local atomic environment using descriptors based on local correlations

Melting point of iron at high pressure: An assessment of uncertainties and effect of electronic temperature

New insights on cellular structures strengthening mechanisms and thermal stability of an austenitic stainless steel fabricated by laser powder-bed-fusion

Predicting phase behavior of grain boundaries with evolutionary search and machine learning

High pressure melt line of nickel using a generalized embedded atomic method potential

Solvation and Dynamics of Sodium and Potassium in Ethylene Carbonate from ab Initio Molecular Dynamics Simulations

Temperature and strain-rate dependence of surface dislocation nucleation

Analysis of defects in In2O3:H synthesized in presence of water vapor and hydrogen gas mixture

The thermodynamics of a liquid-solid interface at extreme conditions: A model close-packed system up to 100 GPa

Energetics and Predissociation Dynamics of Small Water, HCl, and Mixed HCl–Water Clusters

The role of water vapor during the synthesis of hydrogen doped In2O3

In situ TEM observation of FCC Ti formation at elevated temperatures

Interfacial plasticity governs strain rate sensitivity and ductility in nanostructured metals

Time-Resolved Single-Particle X‑ray Scattering Reveals Electron-Density Gradients As Coherent Plasmonic-Nanoparticle-Oscillation Source

Microscopic mechanisms of equilibrium melting of a solid

Accurate parameterization of the kinetic energy functional

Accurate parameterization of the kinetic energy functional for calculations using exact-exchange

Atomistic simulations of rare events using gentlest ascent dynamics

Experimental and Theoretical Investigations of Energy Transfer and Hydrogen-Bond Breaking in the Water Dimer

Experimental and Theoretical Investigations of Energy Transfer and Hydrogen-Bond Breaking in Small Water and HCl Clusters

Temperature-Dependent Configurational Entropy Calculations for Refractory High-Entropy Alloys

Exploring the free energy surface using ab initio molecular dynamics

Light-sheet imaging for the recording of transverse absolute density distributions of gas-phase particle-beams from nanoparticle injectors

On Low Latency Uplink Scheduling for Cellular Haptic Communication to Support Tactile Internet

Optimizing the geometry of aerodynamic lens injectors for single‐particle coherent diffractive imaging of gold nanoparticles

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