Ab initiocalculations of the Ar-ethane intermolecular potential energy surface using bond function basis sets
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference28 articles.
1. Intermolecular interactions between medium-sized systems. Nonempirical and empirical calculations of interaction energies. Successes and failures
2. Applicability of the supermolecule MP2 approach to intermolecular interactions: He2 and Ne2
3. Benchmark calculations with correlated molecular wave functions. V. The determination of accurate ab initio intermolecular potentials for He2, Ne2, and Ar2
4. Mo/ller–Plesset perturbation investigation of the He2 potential and the role of midbond basis functions
5. On the use of bond functions in molecular calculations
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1. Pressure Effects on the Relaxation of an Excited Ethane Molecule in High-Pressure Bath Gases;The Journal of Physical Chemistry A;2021-09-28
2. Ab initiointermolecular potential energy surface of Ne···NCCN van der Waals complex: effect of the place of midbond function on the interaction;Molecular Physics;2015-03-11
3. A density functional tight binding/force field approach to the interaction of molecules with rare gas clusters: Application to (C6H6)+/0Arn clusters;The Journal of Chemical Physics;2014-01-21
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