Development of an electron-temperature-dependent interatomic potential for molecular dynamics simulation of tungsten under electronic excitation

S. Khakshouri; D. Alfè; D. M. Duffy

doi:10.1103/physrevb.78.224304

Development of an electron-temperature-dependent interatomic potential for molecular dynamics simulation of tungsten under electronic excitation

Physical Review B ◽

10.1103/physrevb.78.224304 ◽

2008 ◽

Vol 78 (22) ◽

Cited By ~ 48

Author(s):

S. Khakshouri ◽

D. Alfè ◽

D. M. Duffy

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Electron Temperature ◽

Electronic Excitation ◽

Interatomic Potential ◽

Dynamics Simulation ◽

Temperature Dependent

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Crystallization of the P3Sn4 Phase upon Cooling P2Sn5 Liquid by Molecular Dynamics Simulation Using a Machine Learning Interatomic Potential

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.0c08873 ◽

2021 ◽

Vol 125 (5) ◽

pp. 3127-3133

Author(s):

Chao Zhang ◽

Yang Sun ◽

Hai-Di Wang ◽

Feng Zhang ◽

Tong-Qi Wen ◽

...

Keyword(s):

Machine Learning ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Interatomic Potential ◽

Dynamics Simulation

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Temperature-dependent deformation in silver-particle-covered copper nanowires by molecular dynamics simulation

Journal of Materiomics ◽

10.1016/j.jmat.2021.05.005 ◽

2021 ◽

Author(s):

Pengtao Li ◽

Y.Q. Yang ◽

Vladimir Koval ◽

Xian Luo ◽

Jianxin Chen ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Silver Particle ◽

Dynamics Simulation ◽

Copper Nanowires ◽

Temperature Dependent

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Molecular Dynamics Simulation of the Physics of Thin Film Growth on Silicon: Effects of the Properties of Interatomic Potential Models

Atomistic Simulation of Materials ◽

10.1007/978-1-4684-5703-2_14 ◽

1989 ◽

pp. 139-145

Author(s):

W. Lowell Morgan

Keyword(s):

Thin Film ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Film Growth ◽

Interatomic Potential ◽

Thin Film Growth ◽

Dynamics Simulation ◽

Potential Models

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Interatomic potential for Pd and molecular-dynamics simulation of diffusion in Pd/Pd(111) system

Thin Solid Films ◽

10.1016/s0040-6090(02)01259-2 ◽

2003 ◽

Vol 428 (1-2) ◽

pp. 40-46 ◽

Cited By ~ 13

Author(s):

N.I Papanicolaou ◽

D.A Papaconstantopoulos

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Interatomic Potential ◽

Dynamics Simulation

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Temperature-dependent distribution of silver nano particles on ferroelectric substrate: Molecular dynamics simulation

Ferroelectrics ◽

10.1080/00150193.2018.1497412 ◽

2018 ◽

Vol 531 (1) ◽

pp. 62-71

Author(s):

Yue Liu ◽

Jiaxi Tang ◽

Jiuyang Li ◽

Kai Fu ◽

Haonan Zhu

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Nano Particles ◽

Dynamics Simulation ◽

Temperature Dependent

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Molecular dynamics simulation of metallic Al-Ce liquids using a neural network machine learning interatomic potential

The Journal of Chemical Physics ◽

10.1063/5.0066061 ◽

2021 ◽

Author(s):

Ling Tang ◽

K. M. Ho ◽

Cai-Zhuang Wang

Keyword(s):

Neural Network ◽

Machine Learning ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Interatomic Potential ◽

Dynamics Simulation

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Temperature-Dependent Density and Viscosity of the Ionic Liquids 1-Alkyl-3-methylimidazolium Iodides: Experiment and Molecular Dynamics Simulation

Journal of Chemical & Engineering Data ◽

10.1021/je901092b ◽

2010 ◽

Vol 55 (9) ◽

pp. 3084-3088 ◽

Cited By ~ 97

Author(s):

Mohammad Hadi Ghatee ◽

Morteza Zare ◽

Fatemeh Moosavi ◽

Amin Reza Zolghadr

Keyword(s):

Molecular Dynamics ◽

Ionic Liquids ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Temperature Dependent ◽

Dependent Density

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Temperature-dependent phase transformation of ice-1h under ultrafast uniaxial compression: A molecular dynamics simulation

Computational Materials Science ◽

10.1016/j.commatsci.2019.03.013 ◽

2019 ◽

Vol 162 ◽

pp. 340-348 ◽

Cited By ~ 2

Author(s):

Qiuyun Yin ◽

Lingling Hu ◽

Xianqian Wu ◽

Kailu Xiao ◽

Chenguang Huang

Keyword(s):

Molecular Dynamics ◽

Phase Transformation ◽

Molecular Dynamics Simulation ◽

Uniaxial Compression ◽

Dynamics Simulation ◽

Temperature Dependent

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Molecular Dynamics Simulation Studies of the Temperature-Dependent Structure and Dynamics of Isopropanol–Water Liquid Mixtures at Low Alcohol Content

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.9b05631 ◽

2019 ◽

Vol 123 (35) ◽

pp. 7599-7610 ◽

Cited By ~ 4

Author(s):

Szilvia Pothoczki ◽

László Pusztai ◽

Imre Bakó

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Liquid Mixtures ◽

Dynamics Simulation ◽

Simulation Studies ◽

Temperature Dependent ◽

Alcohol Content ◽

Structure And Dynamics ◽

Low Alcohol

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Molecular dynamics simulation of the temperature-dependent ionic conductivity in sodium(I)-.beta.''-alumina

Chemistry of Materials ◽

10.1021/cm00019a014 ◽

1992 ◽

Vol 4 (1) ◽

pp. 55-62 ◽

Cited By ~ 4

Author(s):

Cathy Lane Rohrer ◽

Gregory C. Farrington

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ionic Conductivity ◽

Dynamics Simulation ◽

Temperature Dependent ◽

Beta Alumina

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