Reference QM Data and MD Simulations for HFO-1234yf/HFO-1234ze(E) and their binary mixtures

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Main Authors: WANG, Haihui, Tse, Ying-Lung Steve
Format: Recurso digital
Published: Zenodo 2026
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author WANG, Haihui
Tse, Ying-Lung Steve
author_facet WANG, Haihui
Tse, Ying-Lung Steve
contents <div> <div>This repository contains the reference quantum mechanical (QM) data and molecular dynamics (MD) simulation files used for force-field optimization and thermodynamic-property calculations of HFO-1234yf, HFO-1234ze(E), and their binary mixtures.</div> </div>
format Recurso digital
id zenodo_https___doi_org_10_5281_zenodo_20115825
institution Zenodo
language
publishDate 2026
publisher Zenodo
record_format zenodo
spellingShingle Reference QM Data and MD Simulations for HFO-1234yf/HFO-1234ze(E) and their binary mixtures
WANG, Haihui
Tse, Ying-Lung Steve
<div> <div>This repository contains the reference quantum mechanical (QM) data and molecular dynamics (MD) simulation files used for force-field optimization and thermodynamic-property calculations of HFO-1234yf, HFO-1234ze(E), and their binary mixtures.</div> </div>
title Reference QM Data and MD Simulations for HFO-1234yf/HFO-1234ze(E) and their binary mixtures
url https://doi.org/10.5281/zenodo.20115825