Studies in hydrogen bonding: simulation of the crystalline solids of ice, ammonia, and ammonia hydrate
Author:
Publisher
Elsevier BV
Subject
Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry
Reference41 articles.
1. Study of the structure of molecular complexes. VI. Dimers and small clusters of water molecules in the Hartree‐Fock approximation
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3. Structure and properties of liquid ammonia
4. Quantum and statistical mechanical studies of liquids. 2. Monte-Carlo simulations of liquid hydrogen fluoride
5. Basis set dependence of the structure and properties of liquid hydrogen fluoride
Cited by 4 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. Hydrogen bonding in solid ammonia fromab initiocalculations;The Journal of Chemical Physics;2003-04
2. Ab initio simulation of ammonia monohydrate (NH3⋅H2O) and ammonium hydroxide (NH4OH);The Journal of Chemical Physics;2001-10-15
3. Single-Crystal Structure and Electron Density Distribution of Ammonia at 160 K on the Basis of X-ray Diffraction Data;The Journal of Physical Chemistry B;1997-07-01
4. Molecular Mechanics Alias Mass Points and Elastic Springs Model of Molecules;Atomic Hypothesis and the Concept of Molecular Structure;1990
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