Machine learning prediction of accurate atomization energies of organic molecules from low-fidelity quantum chemical calculations
Ward, Logan, Blaiszik, Ben, Foster, Ian, Assary, Rajeev S., Narayanan, Badri, Curtiss, LarryLanguage:
english
Journal:
MRS Communications
DOI:
10.1557/mrc.2019.107
Date:
August, 2019
File:
PDF, 554 KB
english, 2019