Introducing ab initio based neural networks for transition-rate prediction in kinetic Monte Carlo simulations
Author:
Funder
Vattenfall
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.95.064112/fulltext
Reference86 articles.
1. Integrated computational materials engineering: A new paradigm for the global materials profession
2. Modeling Microstructure and Irradiation Effects
3. Introducing chemistry in atomistic kinetic Monte Carlo simulations of Fe alloys under irradiation
4. Ab initio calculations and interatomic potentials for iron and iron alloys: Achievements within the Perfect Project
5. Modeling the long-term evolution of the primary damage in ferritic alloys using coarse-grained methods
Cited by 22 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Multi-scale computational study of high-temperature corrosion and the design of corrosion-resistant alloys;Progress in Materials Science;2025-02
2. Prediction of particle agglomeration during nanocolloid drying using machine learning and reduced-order modeling;Chemical Engineering Science;2024-07
3. Generation mechanism of methyl acetate during gas-phase synthesis of vinyl acetate from ethylene on PdAu(100) surface: A combined DFT and kMC study;Molecular Catalysis;2024-04
4. Multiscale modelling of irradiation damage behavior in high entropy alloys;Advanced Powder Materials;2023-07
5. Multi-scale modeling of crystal-fluid interactions: state-of-the-art, challenges and prospects;Reference Module in Chemistry, Molecular Sciences and Chemical Engineering;2023
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3