id: 19
Nov. 20, 2021
Webapp

MToolbox Formation Energy and e-above-hull

University Of South Carolina | 2020

Jianjun Hu;

Description:

Predicting the formation energy/enthalpy or e-above-hull energyfor a given crystal materials formula or structure

Citation:

Hu, Jianjun, Stanislav Stefanov, Yuqi Song, Sadman Sadeed Omee, Steph-Yves Louis, Edirisuriya Siriwardane, and Yong Zhao. "MaterialsAtlas. org: A Materials Informatics Web App Platform for Materials Discovery and Survey of State-of-the-Art." arXiv preprint arXiv:2109.04007 (2021).

Keywords:

balanced electronegativity,

Curator: usccolumbia