Introducing artificial MOFs for improved machine learning predictions: Identification of top-performing materials for methane storage
Author:
Affiliation:
1. Department of Chemistry, University of Crete, Voutes Campus, GR-70013 Heraklion, Crete, Greece
2. Material Engineering Division, Toyota Motor Europe NV/SA, Technical Center, Hoge Wei 33B, 1930 Zaventem, Belgium
Funder
Toyota Motor Europe
European Regional Development Fund of EU and Greece
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://aip.scitation.org/doi/pdf/10.1063/5.0075994
Reference56 articles.
1. Review of computer simulations on anti-cancer drug delivery in MOFs
2. Artificial intelligence in chemistry and drug design
3. Multiscale simulations reveal IRMOF-74-III as a potent drug carrier for gemcitabine delivery
4. Metal–organic framework materials as catalysts
5. Toward Rational Design of Metal–Organic Frameworks for Sensing Applications: Efficient Calculation of Adsorption Characteristics in Zero Loading Regime
Cited by 11 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. Insights into hydrogen and methane storage capacities: Grand canonical Monte Carlo simulations of SIGSUA;The Journal of Chemical Physics;2024-04-18
2. Rapid and Accurate Screening of the COF Space for Natural Gas Purification: COFInformatics;ACS Applied Materials & Interfaces;2024-04-08
3. Grand Canonical Monte Carlo simulations of the hydrogen and methane storage capacities of JLU-MOF120 and JLU-MOF121;International Journal of Hydrogen Energy;2024-04
4. Exploring the hydrogen and methane storage capacities of novel DUT MOFs at room temperature: A Grand Canonical Monte Carlo simulation study;International Journal of Hydrogen Energy;2024-02
5. Accelerating In Silico Discovery of Metal–Organic Frameworks for Ethane/Ethylene and Propane/Propylene Separation: A Synergistic Approach Integrating Molecular Simulation, Machine Learning, and Active Learning;ACS Applied Materials & Interfaces;2024-01-30
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