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ZENODO
Dataset . 2024
License: CC BY
Data sources: ZENODO
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Eindhoven University of Technology Research Portal
Dataset
Data sources: Eindhoven University of Technology Research Portal
image/svg+xml art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos Open Access logo, converted into svg, designed by PLoS. This version with transparent background. http://commons.wikimedia.org/wiki/File:Open_Access_logo_PLoS_white.svg art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos http://www.plos.org/
Eindhoven University of Technology Research Portal
Dataset
License: CC BY
Data sources: Eindhoven University of Technology Research Portal
ZENODO
Dataset . 2024
License: CC BY
Data sources: Datacite
ZENODO
Dataset . 2024
License: CC BY
Data sources: Datacite
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Computing solubility and thermodynamic properties of H2O2 in water

Research datakeyboard_double_arrow_right Dataset 28 Mar 2024 Netherlands Publisher:Zenodo
Authors: Tijin Saji; Bagheri, Behnaz;

doi: 10.5281/zenodo.10600370 , 10.5281/zenodo.10600369

Computing solubility and thermodynamic properties of H2O2 in water

Abstract

The input files used for GROMACS and BRICK software in this work has been uploaded. The dataset contains .itp files for the H2O2 forcefields used and the .mdp file used for a NPT run on aqueous H2O2 solution. GROMACS was used to determine the densities, viscosities and diffusion coefficients of H2O2 in water. Also, BRICK input files (forcefield.in, settings.in, topology.in, H2O2, water, restart.in and weightfunction.in) has been uploaded. BRICK was used to calculate the solubility (Henry coefficient) of H2O2 in water. 

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citations
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average
Related to Research communities
Netherlands Research Portal