Extensions of DFTB to investigate molecular complexes and clusters
Author:
Funder
CALMIP
Publisher
Wiley
Subject
Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/pssb.201100615/fullpdf
Reference225 articles.
1. Design of ferromagnetic alternating stacks of neutral and ion-radical hydrocarbons
2. Polycyclic aromatic hydrocarbons and the unidentified infrared emission bands - Auto exhaust along the Milky Way
3. Variations in the abundance of transiently heated particles within nearby molecular clouds
Cited by 31 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. Exploring Molecular Energy Landscapes by Coupling the DFTB Potential with a Tree-Based Stochastic Algorithm: Investigation of the Conformational Diversity of Phthalates;Journal of Chemical Information and Modeling;2024-03-18
2. Surface tension of liquids and binary mixtures from molecular dynamics simulations;Journal of Physics: Condensed Matter;2021-11-08
3. Understanding the impact of correlation on bond length alternation in polyenes;Theoretical Chemistry Accounts;2021-08
4. The structure of 1,3-butadiene clusters;Theoretical Chemistry Accounts;2021-04
5. SCC-DFTB Parameters for Fe–C Interactions;The Journal of Physical Chemistry A;2020-11-09
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