9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2025-02-09 02:04:11 +01:00
eginer 450a80e307
Some checks failed
continuous-integration/drone/push Build is failing
fixed stupid problem in pt_charges
2023-04-03 14:32:25 +02:00
..
2019-08-30 20:00:29 +02:00
2023-02-07 12:50:33 +01:00
2019-01-25 11:39:31 +01:00
2019-01-25 11:39:31 +01:00
2023-02-07 12:50:33 +01:00
2023-02-07 12:50:33 +01:00
2019-01-25 11:39:31 +01:00

======
nuclei
======

This module contains data relative to the nuclei (coordinates, charge,
nuclear repulsion energy, etc).
The coordinates are expressed in atomic units.