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4 articles related to "Coulomb Potential"

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Articles

Original Research

Published on 05 Dec 2024

Incorporation of charge discreteness and ion correlations into lattice models of ionic liquids

in Theoretical and Computational Chemistry

Guilherme Volpe Bossa
Sylvio May

Frontiers in Chemistry

doi 10.3389/fchem.2024.1502840

1,566 views
2 citations

Brief Research Report

Published on 03 Jul 2019

Comparative Analysis of Electrostatic Models for Ligand Docking

in Molecular Recognition

Geraldo Rodrigues Sartori
Alessandro S. Nascimento

Frontiers in Molecular Biosciences

doi 10.3389/fmolb.2019.00052

5,898 views
9 citations

Original Research

Published on 04 Dec 2020

Tests on the Accuracy and Scalability of the Full-Potential DFT Method Based on Multiple Scattering Theory

in Theoretical and Computational Chemistry

Peiyu Cao
Jun Fang
Xingyu Gao
Fuyang Tian
Haifeng Song

Frontiers in Chemistry

doi 10.3389/fchem.2020.590047

3,164 views
5 citations

Original Research

Published on 25 Jul 2023

Self-consistent numerical solution of quantum regime with exchange-correlation effects of space charges for electron field emission in a nano-gap

in Low-Temperature Plasma Physics

Nan Li
Kai Wu
Yonghong Cheng
Bing Xiao

Frontiers in Physics

doi 10.3389/fphy.2023.1223704

2,995 views
5 citations