The Open Quantum Materials Database (102402)
2018-03-15 10.5072/sdr.kisti.10896616 EDISON-Materials Kirklin Scott
The OQMD is a database of DFT-calculated thermodynamic and structural properties. This online interface is for convenient, small-scale access; for a more powerful utilization of the data, we recommend downloading the entire database and the API for interfacing with it, from the link below.
Quantum Espresso Simulation (1)
2018-04-10 10.5072/sdr.kisti.11626116 EDISON-Materials EDISON Test
Quantum ESPRESSO is an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modeling at the nanoscale.
quantum espresso relaxation