Difference between revisions of "Mpinterfaces"
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|{{#vardefine:app|mpinterfaces}} | |{{#vardefine:app|mpinterfaces}} |
Latest revision as of 12:27, 19 August 2022
Description
Python package that enables high throughput analysis of interfaces(two dimensional materials, hetero-structures, nanoparticles with and without ligands/solvents).
Environment Modules
Run module spider mpinterfaces
to find out what environment modules are available for this application.
System Variables
- HPC_MPINTERFACES_DIR - installation directory
- HPC_MPINTERFACES_BIN - executable directory
- HPC_MPINTERFACES_LIB - library directory
Citation
If you publish research that uses mpinterfaces you have to cite it as follows:
If you use MPInterfaces for your work, please cite the paper