Auxiliary-field quantum Monte Carlo study of TiO and MnO molecules
Author:
Publisher
American Physical Society (APS)
Subject
Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.73.075103/fulltext
Reference32 articles.
1. Quantum Monte Carlo Method using Phase-Free Random Walks with Slater Determinants
2. Quantum Monte Carlo simulations of solids
3. An ab initio study of TiC with the diffusion quantum Monte Carlo method
4. A quantum Monte Carlo study of electron correlation in transition metal oxygen molecules
5. THE DIFFUSION QUANTUM MONTE CARLO METHOD: DESIGNING TRIAL WAVE FUNCTIONS FOR NiO
Cited by 42 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. Toward Linear Scaling Auxiliary-Field Quantum Monte Carlo with Local Natural Orbitals;Journal of Chemical Theory and Computation;2023-12-19
2. Twenty Years of Auxiliary-Field Quantum Monte Carlo in Quantum Chemistry: An Overview and Assessment on Main Group Chemistry and Bond-Breaking;Journal of Chemical Theory and Computation;2022-10-18
3. Emerging quantum computing algorithms for quantum chemistry;WIREs Computational Molecular Science;2021-12-08
4. Mg-doping enhanced superconductivity and ferromagnetism in Ti1−Mg O films;Acta Materialia;2020-11
5. Systematic comparison and cross-validation of fixed-node diffusion Monte Carlo and phaseless auxiliary-field quantum Monte Carlo in solids;Physical Review B;2020-10-07
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