Computational investigation on the molecular driving forces for extraction of Co2+, Ni2+, and Fe3+ in poly(ethylene oxide)/thiocyanate salt aqueous two-phase systems-Reference-Cited by-同舟云学术

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Computational investigation on the molecular driving forces for extraction of Co2+, Ni2+, and Fe3+ in poly(ethylene oxide)/thiocyanate salt aqueous two-phase systems

Published:2024-01 Issue: Volume:223 Page:106220
ISSN:0304-386X
Container-title:Hydrometallurgy
language:en
Short-container-title:Hydrometallurgy

Author:

Silva Lucas Andrade,Prates Letícia Maia,Pereira Alexandre Moni,Correia Julio Cesar Guedes,Neves Heyder Pereira,Mageste Aparecida Barbosa,Ferreira Gabriel Max Dias

Publisher

Elsevier BV

Subject

Materials Chemistry,Metals and Alloys,Industrial and Manufacturing Engineering

Reference65 articles.

1. GROMACS: high performance molecular simulations through multi-level parallelism from laptops to supercomputers;Abraham;SoftwareX,2015

2. Infrared spectroscopic analysis of linkage isomerism in metal−thiocyanate complexes;Baer;J. Chem. Educ.,2010

3. Critical survey of stability constants of complexes of thiocyanate ion (technical report);Bahta;Pure Appl. Chem.,1997

4. Theory of polymer-nanopore interactions refined using molecular dynamics simulations;Balijepalli;J. Am. Chem. Soc.,2013

5. GFN2-xTB—an accurate and broadly parametrized self-consistent tight-binding quantum chemical method with multipole electrostatics and density-dependent dispersion contributions;Bannwarth;J. Chem. Theory Comput.,2019

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