New basis sets for the evaluation of interaction-induced electric properties in hydrogen-bonded complexes
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.23124/fullpdf
Reference58 articles.
1. Interaction-induced electric properties and cooperative effects in model systems
2. Many-body interactions and the electric response of hydrogen-bonded molecular chains
3. New basis sets for the evaluation of interaction energies: an ab initio study of the He–He, Ne–Ne, Ar–Ar, He–Ne, He–Ar and Ne–Ar van der Waals complex internuclear potentials and ro-vibrational spectra
4. The Benzene−Argon Ground-State Intermolecular Potential Energy Surface Revisited
5. Accurate calculation of the intensity dependence of the refractive index using polarized basis sets
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3. Can Density Functional Theory Be Trusted for High-Order Electric Properties? The Case of Hydrogen-Bonded Complexes;Journal of Chemical Theory and Computation;2019-05-13
4. Interaction-induced electric (hyper)polarizability in the dihydrogen–neon pair: basis set and electron correlation effects;Journal of Molecular Modeling;2018-08-31
5. Accurate calculation of optically induced birefringences in chiral systems using efficient polarized basis sets;Physical Chemistry Chemical Physics;2018
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