Classical and path-integral molecular-dynamics study on liquid water and ice melting using non-empirical TTM2.1-F model-Reference-Cited by-同舟云学术

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Classical and path-integral molecular-dynamics study on liquid water and ice melting using non-empirical TTM2.1-F model

Published:2019-08-16 Issue:22 Volume:117 Page:3241-3253
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Yong Xue¹,Burnham Christian J.²,English Niall J.²,Tse John S.¹

Affiliation:

1. Department of Physics and Engineering Physics, University of Saskatchewan, Saskatoon, Canada

2. School of Chemical and Bioprocess Engineering, University College Dublin, Dublin, Ireland

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2019.1652774

Reference48 articles.

1. Isobaric−Isothermal Molecular Dynamics Simulations Utilizing Density Functional Theory: An Assessment of the Structure and Density of Water at Near-Ambient Conditions

2. Density, structure, and dynamics of water: The effect of van der Waals interactions

3. Van der Waals density functionals applied to solids

4. Hydrogen Bonds and van der Waals Forces in Ice at Ambient and High Pressures

5. Two-phase simulation of the crystalline silicon melting line at pressures from –1 to 3 GPa

Cited by 1 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. Anti-icing Ionogel Surfaces: Inhibiting Ice Nucleation, Growth, and Adhesion;ACS Materials Letters;2020-04-30

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