abinit

History

trunk d1c4956f70 Update copyright from 2024 to 2025		2025-02-17 11:50:32 +01:00
..
Input	Final (?) tuning of tolerances for alps_intel_2025_elpa	2025-02-17 09:44:56 +01:00
Refs	Update copyright from 2024 to 2025	2025-02-17 11:50:32 +01:00
README	Initialize tests/v10	2024-03-22 05:55:22 +01:00
__init__.py	Rename Psps_for_tests to Pspdir in all .py and .cmake files.	2024-11-20 18:10:32 +01:00

README

This directory, v5, contains tests which
are related to various developments in
version 5.x.x of Abinit

Please, see the README file in the tests directory (above this one) to get help.



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* Tests 1-4 are related to molecular dynamics

* Tests 5-20 are related to PAW

* Tests 21-29 concern response functions

* Tests 31-37 are related to PAW

* Tests 41-60 concern ground state

* Tests 60-72 concern electronic excitations

* Tests 73-80 concern ground state

* Tests 80-99 concern response functions

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