Semicontinuum (Cluster-Continuum) Modeling of Acid-Catalyzed Aqueous Reactions: Alkene Hydration-Reference-Cited by-同舟云学术

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Semicontinuum (Cluster-Continuum) Modeling of Acid-Catalyzed Aqueous Reactions: Alkene Hydration

Published:2020-10-19 Issue:43 Volume:124 Page:9088-9104
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Patel Darpan H.¹,East Allan L. L.¹^ORCID

Affiliation:

1. Department of Chemistry and Biochemistry, University of Regina, Regina, SK S4S 0A2, Canada

Funder

Canada Foundation for Innovation

Deutsche Forschungsgemeinschaft

Natural Sciences and Engineering Research Council of Canada

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.0c07011

Reference78 articles.

1. Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics

2. Quantum Mechanical Continuum Solvation Models

3. The COSMO and COSMO‐RS solvation models

4. The IEF version of the PCM solvation method: an overview of a new method addressed to study molecular solutes at the QM ab initio level

5. New developments in the polarizable continuum model for quantum mechanical and classical calculations on molecules in solution

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