Benchmark calculations for molecules in the gas phase: State-of-the-art coupled-cluster computations
Author:
Funder
MIUR
CNR
University of Bologna
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/qua.22132/fullpdf
Reference103 articles.
1. A fifth-order perturbation comparison of electron correlation theories
2. The full CCSDT model for molecular electronic structure
3. A new implementation of the full CCSDT model for molecular electronic structure
4. The coupled‐cluster single, double, and triple excitation model for open‐shell single reference functions
5. The implementation of the multireference coupled‐cluster method based on the single‐reference formalism
Cited by 29 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. The chemistry of H2NC in the interstellar medium and the role of the C + NH3 reaction;Astronomy & Astrophysics;2023-04-28
2. Quantum-Chemical Methods;Lecture Notes in Chemistry;2023
3. Energy Landscape and Structural and Spectroscopic Characterization of Diazirine and Its Cyclic Isomers;The Journal of Physical Chemistry A;2022-07-19
4. Effective and equilibrium structures of XY -type molecules: SCl2, PF2, PO2, ZrO2, and CF2S as additional example and nonbonded distances F…F, Cl…Cl and O…O;Journal of Molecular Spectroscopy;2022-05
5. Photoelectron spectroscopy of low valent organophosphorus compounds, P–CH3, H–PCH2 and PCH2;Physical Chemistry Chemical Physics;2022
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