/tools/QCSchema
QCSchema
MolSSI/QCSchema
summary
QCSchema is a schema designed to standardize the representation of quantum chemistry data, allowing for easier integration and manipulation of data from various quantum chemistry packages. It aims to streamline workflows by providing a consistent format for output variables, making it easier to work with complex quantum chemistry computations.
description
A Schema for Quantum Chemistry
topics
quantum-chemistryschema
Ratings
N/A
0 ratings
Rate this tool: