On the Computational Characterization of Charge-Transfer Effects in Noncovalently Bound Molecular Complexes-Reference-Cited by-同舟云学术

On the Computational Characterization of Charge-Transfer Effects in Noncovalently Bound Molecular Complexes

Published:2018-04-03 Issue:5 Volume:14 Page:2401-2417
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Mao Yuezhi¹^ORCID,Ge Qinghui¹²,Horn Paul R.¹,Head-Gordon Martin¹²^ORCID

Affiliation:

1. Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California at Berkeley, Berkeley, California 94720, United States

2. Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States

Funder

Division of Chemistry

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.7b01256

Reference115 articles.

1. The Theory of Intermolecular Forces

2. Electron transfer reactions in chemistry. Theory and experiment

3. Quantum chemical probes of electron-transfer kinetics: the nature of donor-acceptor interactions

4. Charge Transfer from Regularized Symmetry-Adapted Perturbation Theory

5. Alkyl Radicals as Hydrogen Bond Acceptors: Computational Evidence

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