About the evaluation of the local kinetic, potential and total energy densities in closed-shell interactions
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference17 articles.
1. Atoms in molecules: a quantum theory;Bader,1990
2. On the Possibility of Kinetic Energy Density Evaluation from the Experimental Electron-Density Distribution
3. Hydrogen bond strengths revealed by topological analyses of experimentally observed electron densities
4. Experimental electron density overlapping in hydrogen bonds: topology vs. energetics
5. Topological analysis of the electron density in hydrogen bonds
Cited by 395 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. Theoretical investigation of the effects of diverse hydrogen-bonding characteristics on the 17O chemical shielding and electric field gradient tensors within the active sites of MraYAA bound to nucleoside antibiotics capuramycin, carbacaprazamycin, 3′-Hydroxymureidomycin A, and muraymycin D2;Solid State Nuclear Magnetic Resonance;2024-10
2. Electrospun PVP Fibers as Carriers of Ca2+ Ions to Improve the Osteoinductivity of Titanium-Based Dental Implants;Molecules;2024-09-03
3. Cooperativity and halonium transfer in the ternary NCI···CH 3 I··· - CN halogen-bonded complex: An ab initio gas phase study;2024-08-07
4. Formulating Reduced Density Gradient Approaches for Noncovalent Interactions;The Journal of Physical Chemistry A;2024-07-23
5. Alendronate as Bioactive Coating on Titanium Surfaces: An Investigation of CaP–Alendronate Interactions;Materials;2024-06-03
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