DiSCoVeR: a materials discovery screening tool for high performance, unique chemical compositions-Reference-Cited by-同舟云学术

DiSCoVeR: a materials discovery screening tool for high performance, unique chemical compositions

Published:2022 Issue:3 Volume:1 Page:226-240
ISSN:2635-098X
Container-title:Digital Discovery
language:en
Short-container-title:Digital Discovery

Author:

Baird Sterling G.¹^ORCID,Diep Tran Q.²^ORCID,Sparks Taylor D.¹^ORCID

Affiliation:

1. Department of Materials Science and Engineering, University of Utah, Salt Lake City, UT 84108, USA

2. Department of Chemical Engineering, Brigham Young University, Provo, UT 84604, USA

Abstract

We present the DiSCoVeR algorithm (https://github.com/sparks-baird/mat_discover), a Python tool for identifying and assessing high-performing, chemically unique compositions relative to existing compounds.

Funder

Division of Materials Research

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2022/DD/D1DD00028D

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