Litcius/Paper detail

Automation in DFT-based computational materials science

Janine George

2021Trends in Chemistry16 citationsDOI

Topics & Concepts

AutomationComputer scienceSoftwareThroughputLaboratory automationRange (aeronautics)Software engineeringComputational scienceEngineeringProgramming languageOperating systemMechanical engineeringWirelessAerospace engineeringMachine Learning in Materials ScienceElectronic and Structural Properties of OxidesCatalysis and Oxidation Reactions
Automation in DFT-based computational materials science | Litcius