Efficient importance sampling in semiclassical initial value representation calculations for time correlation functions
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s00214-014-1448-y.pdf
Reference50 articles.
1. Clary DC (2008) Quantum dynamics of chemical reactions. Science 321:789–791
2. Xiao C, Xu X, Liu S, Wang T, Dong W, Yang T, Sun Z, Dai D, Xu X, Zhang DH, Yang X (2011) Experimental and theoretical differential cross sections for a four-atom reaction: HD + OH → H2O + D. Science 333:440–442
3. Kosloff R (1988) Time-dependent quantum-mechanical methods for molecular dynamics. J Phys Chem 92:2087–2100
4. Beck MH, Jackle A, Worth GA, Meyer HD (2000) The multiconfiguration time-dependent Hartree (MCTDH) method: a highly efficient algorithm for propagating wavepackets. Phys Rep 324:1–105
5. Wang H, Thoss M (2003) Multilayer formulation of the multiconfiguration time-dependent Hartree theory. J Chem Phys 119:1289–1299
Cited by 6 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. A Semiclassical Framework for Mixed Quantum Classical Dynamics;The Journal of Physical Chemistry A;2022-09-07
2. Semiclassical vibrational spectroscopy with Hessian databases;The Journal of Chemical Physics;2019-06-28
3. Vibrational investigation of nucleobases by means of divide and conquer semiclassical dynamics;The Journal of Chemical Physics;2019-06-14
4. Semiclassical “Divide-and-Conquer” Method for Spectroscopic Calculations of High Dimensional Molecular Systems;Physical Review Letters;2017-07-06
5. On-the-Fly ab Initio Semiclassical Calculation of Glycine Vibrational Spectrum;Journal of Chemical Theory and Computation;2017-05-26
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