Full configuration-interaction and coupled-cluster calculations of the indirect spin–spin coupling constant of BH
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference34 articles.
1. Ab Initio Methods for the Calculation of NMR Shielding and Indirect Spin−Spin Coupling Constants
2. Calculations of nuclear spin—spin coupling constants
3. Quantum Mechanical Electronic Structure Calculations with Chemical Accuracy;Lee,1995
4. Encyclopedia of Computational Chemistry;Gauss,1998
Cited by 33 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. Indirect nuclear spin–spin couplings with third-order contributions added to the SOPPA method;The Journal of Chemical Physics;2023-03-28
2. Quantum Chemical Approaches to the Calculation of NMR Parameters: From Fundamentals to Recent Advances;Magnetochemistry;2022-05-05
3. The aug‐cc‐pVTZ‐J basis set for the p ‐block fourth‐row elements Ga, Ge, As, Se, and Br;Magnetic Resonance in Chemistry;2021-05-16
4. The Shape of Full Configuration Interaction to Come;The Journal of Physical Chemistry Letters;2020-12-24
5. A case study of density functional theory and domain-based local pair natural orbital coupled cluster for vibrational effects on EPR hyperfine coupling constants: vibrational perturbation theory versus ab initio molecular dynamics;Molecular Physics;2020-07-31
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