A new ab initio based six-dimensional semi-empirical pair interaction potential for HF
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference36 articles.
1. HF Vapor
2. Vibrational spectra of (HF)2, (HF)n and their D-isotopomers: Mode selective rearrangements and nonstatistical unimolecular decay
3. Coupled pair functional study on the hydrogen fluoride dimer. I. Energy surface and characterization of stationary points
Cited by 90 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. Mode‐Selective Vibrational‐Tunneling Dynamics in theN=2 Triad of the Hydrogen‐Bonded (HF)2Cluster;Israel Journal of Chemistry;2023-07-31
2. Analytical angular solutions for the atom–diatom interaction potential in a basis set of products of two spherical harmonics: two approaches;Journal of Mathematical Chemistry;2021-08-25
3. Variational analysis of HF dimer tunneling rotational spectra using an ab initio potential energy surface;Journal of Molecular Spectroscopy;2021-05
4. New Molecular-Mechanics Model for Simulations of Hydrogen Fluoride in Chemistry and Biology;Journal of Chemical Theory and Computation;2020-07-02
5. Weakly bound molecular dimers: Intramolecular vibrational fundamentals, overtones, and tunneling splittings from full-dimensional quantum calculations using compact contracted bases of intramolecular and low-energy rigid-monomer intermolecular eigenstates;The Journal of Chemical Physics;2019-07-14
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