|description=widely used quantum chemistry software
|fields=Computational chemistry
1 KB (196 words) - 13:53, 12 September 2011
*Application expert in computational chemistry
...postdoctoral experience in the field covering applications within organic chemistry, biochemistry, and life science
5 KB (702 words) - 13:38, 8 July 2011
...different SNIC centers. The presented software include for instance VASP, Quantum Espresso, RSPt, AiiDA, Gaussian and Jaguar.
1 KB (209 words) - 16:22, 27 February 2017
|fields=Computational materials science; Computational chemistry
[http://www.quantum-espresso.org {{PAGENAME}}] (opEn Source Package for Research in Electronic
703 bytes (79 words) - 12:34, 12 September 2011
|description=ab initio quantum mechanics
|fields= Computational chemistry
440 bytes (51 words) - 12:30, 12 September 2011
|description=ab initio quantum chemistry
|fields=Computational materials science; Computational chemistry
781 bytes (102 words) - 15:58, 8 February 2012
|description=ab initio quantum chemistry
|fields=Computational chemistry
514 bytes (67 words) - 15:41, 19 September 2011
|fields=Computational materials science; Computational chemistry
...on the Kohn-Sham wave functions generated by the free DFT codes Abinit and Quantum Espresso.
725 bytes (94 words) - 10:46, 14 March 2013
=== CHARMM (Chemistry at HARvard Macromolecular Mechanics) ===
=== Quantum Espresso ===
8 KB (1,130 words) - 12:24, 6 April 2020
|description=ENCCS/PDC VeloxChem Workshop: Quantum Chemistry from Laptop to HPC
|fields=VeloxChem; Quantum chemistry; High performance computing
2 KB (258 words) - 14:51, 1 April 2021
|description=ENCCS/PDC VeloxChem Workshop: Quantum Chemistry Towards Pre-exascale and Beyond
|fields=VeloxChem; Quantum chemistry; High performance computing
2 KB (310 words) - 08:55, 4 February 2022
