Empirical valence bond
id:
empirical-valence-bond-320-8135144
title:
Empirical valence bond
text:
In theoretical chemistry, the Empirical Valence Bond (EVB) approach is an approximation for calculating free-energies of a chemical reaction in condensed-phase. It was first developed by Israeli chemist Arieh Warshel, and was inspired by the way Marcus theory uses potential surfaces to calculate the probability of electron transfer. Where most methods for reaction free-energy calculations require at least some part of the modeled system to be treated using quantum mechanics, EVB uses a calibrate
brand slug:
wiki
category slug:
encyclopedia
description:
Method of calculating chemical reaction free energies
original url:
https://en.wikipedia.org/wiki/Empirical_valence_bond
date created:
date modified:
2023-09-08T11:40:25Z
main entity:
{"identifier":"Q19597065","url":"https://www.wikidata.org/entity/Q19597065"}
image:
{"content_url":"https://upload.wikimedia.org/wikipedia/commons/7/75/EVB_example_plot.png","width":675,"height":442}
fields total:
13
integrity:
15