ReaxFF reactive force field for molecular dynamics simulations of liquid Cu and Zr metals
出版年份 2019 全文链接
标题
ReaxFF reactive force field for molecular dynamics simulations of liquid Cu and Zr metals
作者
关键词
-
出版物
JOURNAL OF CHEMICAL PHYSICS
Volume 151, Issue 9, Pages 094503
出版商
AIP Publishing
发表日期
2019-09-06
DOI
10.1063/1.5112794
参考文献
相关参考文献
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- Strength of the repulsive part of the interatomic potential determines fragility in metallic liquids
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- (2016) S. Pal et al. MATERIALS & DESIGN
- Mechanism of abnormally slow crystal growth of CuZr alloy
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- Interatomic repulsion softness directly controls the fragility of supercooled metallic melts
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- Crystallization pathways of liquid-bcc transition for a model iron by fast quenching
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- (2011) Yong J. Lv et al. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
- Highly optimized embedded-atom-method potentials for fourteen fcc metals
- (2011) H. W. Sheng et al. PHYSICAL REVIEW B
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- (2010) John A. Keith et al. PHYSICAL REVIEW B
- Molecular dynamics study of stable and undercooled liquid zirconium based on MEAM interatomic potential
- (2009) A.E. Gheribi MATERIALS CHEMISTRY AND PHYSICS
- Atomic Level Structure in Multicomponent Bulk Metallic Glass
- (2009) Y. Q. Cheng et al. PHYSICAL REVIEW LETTERS
- ReaxFF Reactive Force Field for Solid Oxide Fuel Cell Systems with Application to Oxygen Ion Transport in Yttria-Stabilized Zirconia
- (2008) Adri C. T. van Duin et al. JOURNAL OF PHYSICAL CHEMISTRY A
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