Calculation of the stability of nonperiodic solids using classical force fields and the method of increments: N2o as an example-Reference-Cited by-同舟云学术

登录注册会员服务联系我们

Calculation of the stability of nonperiodic solids using classical force fields and the method of increments: N2o as an example

Published:2015-05-14 Issue:18 Volume:36 Page:1420-1427
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Müller Carsten¹,Spångberg Daniel²

Affiliation:

1. Institut für Chemie und Biochemie, Physikalische und Theoretische Chemie, Freie Universität Berlin; Takustraße 3 14195 Berlin Germany

2. The Ångström Laboratory; Department of Chemistry; Box 538, 751 21 Uppsala, Sweden, present address: Solstrålevägen 135 74335 Storvreta Sweden

Funder

Deutsche Forschungsgemeinschaft

Göran Gustafsson foundation

Swedish Research Council

Swedish strategic e-science research program eSSENCE

Zentraleinrichtung für Datenverarbeitung (ZEDAT) der Freien Universität Berlin

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference62 articles.

1. THE HEAT CAPACITY AND ENTROPY OF CARBON MONOXIDE. HEAT OF VAPORIZATION. VAPOR PRESSURES OF SOLID AND LIQUID. FREE ENERGY TO 5000°K. FROM SPECTROSCOPIC DATA

2. The Heat Capacity and Vapor Pressure of Solid and Liquid Nitrous Oxide. The Entropy from its Band Spectrum

3. Energies of Disorientation in Solid Carbon Monoxide and Nitrous Oxide1

4. Head-tail disorder and reorientation in solidN2O and CO: Dielectric study

Cited by 5 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. The Crystal Structure of α‐F 2 : Solving a 50 Year Old Puzzle Computationally;Chemistry – A European Journal;2019-02-06

2. Periodic and fragment models based on the local correlation approach;WIREs Computational Molecular Science;2018-01-17

3. Ab initio prediction of the polymorph phase diagram for crystalline methanol;Chemical Science;2018

4. Effects of a More Accurate Polarizable Hamiltonian on Polymorph Free Energies Computed Efficiently by Reweighting Point-Charge Potentials;Journal of Chemical Theory and Computation;2016-07-25

5. Modeling Polymorphic Molecular Crystals with Electronic Structure Theory;Chemical Reviews;2016-03-23

同舟云学术

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