Assessment of various density functionals and solvation models to describe acid-base, spectral and complexing properties of thiobarbituric and barbituric acids in aqueous solution-Reference-Cited by-同舟云学术

Assessment of various density functionals and solvation models to describe acid-base, spectral and complexing properties of thiobarbituric and barbituric acids in aqueous solution

Published:2017-11-24 Issue:4 Volume:17 Page:851-863
ISSN:1472-7978
Container-title:Journal of Computational Methods in Sciences and Engineering
language:
Short-container-title:JCM

Author:

Lutoshkin Maxim A.¹²,Kazachenko Alexandr S.¹

Affiliation:

1. Federal Research Center “Krasnoyarsk Science Center SB RAS”, Institute of Chemistry and Chemical Technology SB RAS, Krasnoyarsk, Russia

2. Institut de Recherches sur la Catalyse et L’environnement de Lyon, Université de Lyon, Université Claude Bernard Lyon 1, IRCELYON, Villeurbanne, France

Publisher

IOS Press

Subject

Computational Mathematics,Computer Science Applications,General Engineering

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