LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2024-07-23 11:17:33 +02:00
Code Issues Releases Wiki Activity

Fixed travis

Browse Source
This commit is contained in:
Anthony Scemama 2018-02-09 17:59:50 +01:00
parent 572639e632
commit d8b94c0473
3 changed files with 9 additions and 2 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

2
plugins/Properties/NEEDED_CHILDREN_MODULES
View File

@ -1 +1 @@
Determinants
Determinants Davidson

9
src/Davidson_Utils/README.rst
View File

@ -1,4 +1,11 @@
Abstract module for Davidson diagonalization.
Davidson_Utils
==============
Abstract module for Davidson diagonalization. Contains everything required for the
Davidson algorithm, dressed or not. If a dressing is used, the dressing column should
be defined and the DavidsonDressed module should be used. If no dressing is required,
the Davidson module should be used, and it has a default null dressing vector.
Needed Modules
==============

0
src/DavidsonDressed/diagonalization_hs2_dressed.irp.f → src/Davidson_Utils/diagonalization_hs2_dressed.irp.f
View File