Assessment of G3(MP2)//B3 theory including a pseudopotential for molecules containing first-, second-, and third-row representative elements
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4826519
Reference45 articles.
1. Gaussian-3 (G3) theory for molecules containing first and second-row atoms
2. Assessment of Gaussian-3 and density functional theories for a larger experimental test set
3. Gaussian-3 theory: a variation based on third-order perturbation theory and an assessment of the contribution of core-related correlation
4. Gaussian-3X (G3X) theory: Use of improved geometries, zero-point energies, and Hartree–Fock basis sets
5. Gaussian-4 theory
Cited by 18 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. Brueckner Doubles variation of W1 theory (W1BD) adapted to pseudopotential: W1BDCEP theory;Journal of Molecular Modeling;2022-09
2. Determination of the standard enthalpy of formation of iodine compounds through the G2 and G3(MP2)//B3-SBK theories;Journal of Molecular Modeling;2022-08-05
3. Systematic Convergence of the Numerical Taylor Series to the Best Standard and Its Potential Implication for the Development of Composite Methods;Journal of Chemical Theory and Computation;2021-03-10
4. Heats of formation for aluminium compounds with EnAt1 and EnAt2;Theoretical Chemistry Accounts;2020-07-22
5. W2SDD theory for computational thermochemistry: study of the addition of hydrogen halide to propene;Theoretical Chemistry Accounts;2020-06-23
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