Implementation of Laplace Transformed MP2 for Periodic Systems With Numerical Atomic Orbitals
Author:
Publisher
Frontiers Media SA
Subject
General Chemistry
Reference26 articles.
1. Atomic orbital laplace-transformed second-order Møller-plesset theory for periodic systems;Ayala;J. Chem. Phys,2001
2. Linear scaling second-order Moller–Plesset theory in the atomic orbital basis for large molecular systems;Ayala;J. Chem. Phys,1999
3. “Applications of post-hartree-fock methods: a tutorial,”;Bartlett,2007
4. Tighter multipole-based integral estimates and parallel implementation of linear-scaling AO–MP2 theory;Doser;Phys. Chem. Chem. Phys,2008
5. Møller-Plesset (MP2) perturbation theory for large molecules;Häser;Theor. Chim. Acta,1993
Cited by 4 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. Effects of Al/Si ratio and crystallite size on the dissolution rate of aluminosilicate glass and low-calcium SCMs under alkaline condition;Materials Today Chemistry;2023-10
2. Further investigations into a Laplace MP2 method using range separated Coulomb potential and orbital selective virtuals: Multipole correction, OSV extrapolation, and critical assessment;The Journal of Chemical Physics;2023-03-21
3. Approaching the basis set limit in Gaussian-orbital-based periodic calculations with transferability: Performance of pure density functionals for simple semiconductors;The Journal of Chemical Physics;2021-10-28
4. Toward Laplace MP2 method using range separated Coulomb potential and orbital selective virtuals;The Journal of Chemical Physics;2021-10-21
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