Performance of Range Separated Density Functional in Solvent Continuum: Tuning Long‐range Hartree–Fock Exchange for Improved Orbital Energies-Reference-Cited by-同舟云学术

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Performance of Range Separated Density Functional in Solvent Continuum: Tuning Long‐range Hartree–Fock Exchange for Improved Orbital Energies

Published:2019-11-11 Issue:4 Volume:41 Page:295-304
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Boruah Abhijit¹^ORCID,Borpuzari Manash Protim¹^ORCID,Kar Rahul¹

Affiliation:

1. Department of ChemistryDibrugarh University Dibrugarh Assam 786004 India

Funder

University Grants Commission

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26101

Reference53 articles.

1. Challenges for Density Functional Theory

2. Molecular Interactions in Solution: An Overview of Methods Based on Continuous Distributions of the Solvent

3. Comparison of simple potential functions for simulating liquid water

4. The missing term in effective pair potentials

5. Quantum Mechanical Continuum Solvation Models

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