Density of States Partitioning Method for Calculating the Free Energy of Solids
Author:
Affiliation:
1. School of Chemistry, University of Nottingham, University Park, Nottingham NG7 2RD, U.K.
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct3007056
Reference41 articles.
1. Phase Transitions of the Lennard-Jones System
2. A simulation method for calculating the absolute entropy and free energy of fluids: Application to liquid argon and water
3. Absolute Free-Energy Calculations of Liquids Using a Harmonic Reference State
4. Monte Carlo study of a phase‐separating liquid mixture by umbrella sampling
5. Optimized Monte Carlo data analysis
Cited by 19 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 phase diagram of Mercedes Benz model of water using nested sampling algorithm and molecular dynamics simulations;Fluid Phase Equilibria;2024-11
2. The Phase Diagram of Mercedes Benz Model of Water Using Nested Sampling Algorithm and Molecular Dynamics Simulations;2024
3. A novel Bayesian reconstruction of the configurational density of states;Computational Materials Science;2023-09
4. Phase diagrams—Why they matter and how to predict them;The Journal of Chemical Physics;2023-01-21
5. Quantum Rényi entropy by optimal thermodynamic integration paths;Physical Review Research;2022-07-05
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