espresso/6.4+intelmpi-2018.2.199+intel-18.0¶
- name
- Quantum ESPRESSO
- version
- 6.4. compiled with intelmpi/2018.2.199+intel-18.0
- description
- Suite of codes for electronic-structure calculations and nanoscale materials modeling
- url
- http://www.quantum-espresso.org/
- license
- opensource
- built
- Mon Mar 25 11:07:03 CDT 2019
- dependencies
- mkl/2018.up2, libxc/4.2.3+intel-18.0
- tags
- chemistry, materials, molecular dynamics
- usage
- Use the module system to load this version of espresso:
module load midway2; module load espresso/6.4+intelmpi-2018.2.199+intel-18.0
See also
- amber/16, amber/16+intelmpi-2018.2.199+intel-18.0, amber/18, amber/18+intelmpi-2017.up4+intel-17.0, amber/20+intelmpi-2017.up4+intel-17.0 (default)
- All versions available for espresso.
- Software Modules
- Full list of software modules available on Midway.
- Software Modules Tutorial
- A tutorial on Midway modules and how to use them.