Search

Categories

Energy

(1)

Inorganic Chemistry

(1)

Materials Chemistry

(1)

Theoretical and Computational Chemistry

(2)

Content Types

Working Paper

(2)

Published Date

Over 3 years

(2)

Keywords

computational discovery

Authors

2 results in Keywords: computational discovery

Theoretical and Computational Chemistry

Computational Discovery of Promising New n-type Dopable ABX Zintl Thermoelectric Materials

Prashun Gorai, Alex Ganose, Alireza Faghaninia, Anubhav Jain, Vladan Stevanovic

Version 1 posted 07 February 2020

860

Downloads

Theoretical and Computational Chemistry

Stk: An Extendable Python Framework for Automated Molecular and Supramolecular Structure Assembly and Discovery

Lukas Turcani, Andrew Tarzia, Filip Szczypiński, Kim Jelfs

Version 2 posted 10 May 2021

579

Downloads