Difference between revisions of "BoltzTraP"
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| − | + | Run <code>module spider {{#var:app}}</code> to find out what environment modules are available for this application. | |
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==System Variables== | ==System Variables== | ||
* HPC_{{uc:{{#var:app}}}}_DIR - installation directory | * HPC_{{uc:{{#var:app}}}}_DIR - installation directory | ||
Latest revision as of 16:19, 10 June 2022
Description
Boltzmann Transport Properties (BoltzTraP) is a program for calculating the semi-classic transport coefficients. The code uses a mesh of self-consistent band energies and is interfaced to the WIEN2k, AB-INIT, SIESTA, VASP and QuantumEspresso programs.
Environment Modules
Run module spider boltztrap to find out what environment modules are available for this application.
System Variables
- HPC_BOLTZTRAP_DIR - installation directory
Citation
If you publish research that uses boltztrap you have to cite it as follows:
Madsen, G. K. H.*; Singh, D. J. Comput. Phys. Commun. 2006 175, 67