A general quantum chemical approach to study the locally perturbed periodic systems: A new development of the ab initio crystal elongation method
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.470100
Reference44 articles.
1. The effect of an impurity in quasi-one-dimensional systems: Green's function and cluster model approach in comparison
2. Recent developments in the quantum theory of organic polymers
3. Theoretical model studies for surface-molecule interacting systems
4. Modifications for ab initio calculations of the moderately large‐embedded‐cluster model. Hydrogen adsorption on a lithium surface
5. Ab-initio Hartree-Fock perturbed-cluster treatment of local chemisorption
Cited by 9 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. Akira Imamura: a scientific memoir (1950–2011);Theoretical Chemistry Accounts;2011-08-27
2. Elongation Method: Towards Linear Scaling for Electronic Structure of Random Polymers and other Quasilinear Materials;Challenges and Advances in Computational Chemistry and Physics;2011
3. Symmetry-adapted-cluster/symmetry-adapted-cluster configuration interaction methodology extended to giant molecular systems: Ring molecular crystals;The Journal of Chemical Physics;2007-02-28
4. ELONGATION METHOD FOR POLYMERS AND ITS APPLICATION TO NONLINEAR OPTICS;Atoms, Molecules and Clusters in Electric Fields;2006-07
5. Calculations of phase transition of polydiacetylenes using localized molecular orbitals by elongation method;The Journal of Chemical Physics;1998-06-22
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