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QuantumPackage/src/trexio
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Anthony Scemama 2f8e7bd4f7 Updated to read CHolesky MO integrals from TREXIO
2024-07-03 15:32:38 +02:00
..
export_trexio_routines.irp.f Updated to read CHolesky MO integrals from TREXIO 2024-07-03 15:32:38 +02:00
export_trexio.irp.f Adapted trexio file for full path 2024-03-05 15:37:09 +01:00
EZFIO.cfg Fix modifying determinants before mo_label exists 2023-11-27 14:25:05 +01:00
import_trexio_determinants.irp.f Updated documentation 2024-03-20 16:06:44 +01:00
import_trexio_integrals.irp.f Updated to read CHolesky MO integrals from TREXIO 2024-07-03 15:32:38 +02:00
LIB Changed how libraries are handled 2023-09-19 14:43:42 +02:00
NEED Added NEED in trexio 2023-05-12 19:58:15 +02:00
README.rst Added TREXIO module 2023-05-11 22:48:48 +02:00
trexio_file.irp.f Added TREXIO module 2023-05-11 22:48:48 +02:00
trexio_module.F90 Added TREXIO module 2023-05-11 22:48:48 +02:00

README.rst 

======
trexio
======

Module for handling TREXIO files.
See https://github.com/trex-coe/trexio