Code Generation in ORCA with AGE II. Calculation Data.

DOI

Repository containing the ORCA, MRCC and CFOUR output files that showcase the new capabilities of the ORCA's code generator, the Automated Generator Environment (AGE).

Identifier
DOI https://doi.org/10.17617/3.CWGUUL
Metadata Access https://edmond.mpg.de/api/datasets/export?exporter=dataverse_json&persistentId=doi:10.17617/3.CWGUUL
Provenance
Creator Papadopoulos, Anastasios
Publisher Edmond
Publication Year 2024
OpenAccess true
Contact neese(at)kofo.mpg.de
Representation
Language English
Resource Type Dataset
Version 1
Discipline Other