COMBO: An efficient Bayesian optimization library for materials science
Author:
Funder
RIKEN PostK
NIMS MI2I
Kakenhi Nanostructure
Kakenhi
JST CREST
Publisher
Elsevier BV
Subject
General Materials Science,Information Systems
Reference20 articles.
1. Active-learning strategies in computer-assisted drug discovery;Reker;Drug Discov. Today,2015
2. Crystal structure prediction using ab initio evolutionary techniques: principles and applications;Oganov;J. Chem. Phys.,2006
3. Predicting potent compounds via model-based global optimization;Ahmadi;J. Chem. Inf. Model.,2013
4. Machine learning with systematic density-functional theory calculations: application to melting temperatures of single- and binary-component solids;Seko;Phys. Rev. B,2014
5. Prediction of low-thermal-conductivity compounds with first-principles anharmonic lattice-dynamics calculations and Bayesian optimization;Seko;Phys. Rev. Lett.,2015
Cited by 221 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. Designing width modulation of nanowaveguides for minimum phonon conduction with calculations and Bayesian optimization;Solid State Sciences;2024-03
2. A dynamic Bayesian optimized active recommender system for curiosity-driven partially Human-in-the-loop automated experiments;npj Computational Materials;2024-02-03
3. On Accelerating Substrate Optimization Using Computational Gibbs Energy Barriers: A Numerical Consideration Utilizing a Computational Data Set;ACS Omega;2024-01-29
4. Multipoint-BAX: a new approach for efficiently tuning particle accelerator emittance via virtual objectives;Machine Learning: Science and Technology;2024-01-10
5. Structural changes in the lithium cobalt dioxide electrode: A combined approach with cluster expansion and Bayesian optimization;Physical Review Materials;2023-11-13
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