409 citations · 1.1k across the 33 of their papers we have counts for
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cond-mat.mtrl-sci2019★ 19 cited
Database-driven High-Throughput Calculations and Machine Learning Models for Materials Design
Rickard Armiento
This paper reviews past and ongoing efforts in using high-throughput ab-inito calculations in combination with machine learning models for materials design. The primary focus is on…
cond-mat.str-el2019★ 1 cited
Semi-Local Parameterization of the Electron Localization Function in Second-Order Density Gradients
Alexander Lindmaa, Joel Davidsson, Ann E. Mattsson +1
The electron localization function (ELF) is a universal measure of electron localization that allows for, e.g., an effective characterization of physical bonds in molecular and sol…