PTEROSOR/QuantumPackage
10
0
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-23 04:43:45 +01:00
Code Releases Activity
7df04ab04e
QuantumPackage/etc
History
Anthony Scemama cebc19a601
Merge Master (#69) 
* Changed native into SSE4.2 in gfortran.cfg

* Fixed rm opam_installer

* Fix configure

* Improving scaling of pt2 with network

* Router/dealer in qp_tunnel

* Reduced size of qp2.png

* Exclude temp files in tar

* Introduce NO_CACHE in configure for daily test

* Faster determinants in OCaml

* We always give max 10k dets in qp_edit. Read-only if more

* Fixed save_natorb

* Fixing bug in qp_edit

* Comments

* Biblio (#61)

* Biblio (#62)

* Update biblio

* Update paper

* Journal missing in research.bib

* Added paper

* Fixed Pierre Francois

* Checking number of electrons in MOs

* Biblio (#64)

* Update biblio

* Update paper

* Journal missing in research.bib

* Added paper

* Fixed Pierre Francois

* 2 papers

* Fixed 6-31G and quickstart (#65)

* Fixed 6-31 basis sets

* Bug in quickstart

* Biblio (#66)

* Bugfix (#67)

* Fixing opam installation

* Fixed 6-31 basis sets

* Bug in quickstart

* Use irpf90 v1.7.6

* Fix IRPF90 Path
2019-10-21 16:45:00 +02:00
..
.gitignore Fixed local.rc 2019-05-15 16:02:41 +02:00
autocomplete.rc Initial commit 2019-01-25 11:39:31 +01:00
configure.rc Initial commit 2019-01-25 11:39:31 +01:00
ezfio.rc Initial commit 2019-01-25 11:39:31 +01:00
irpf90.rc Merge Master (#69) 2019-10-21 16:45:00 +02:00
libraries.rc Initial commit 2019-01-25 11:39:31 +01:00
local.rc Fixed local.rc 2019-05-15 16:02:41 +02:00
ninja.rc Initial commit 2019-01-25 11:39:31 +01:00
ocaml.rc Initial commit 2019-01-25 11:39:31 +01:00
paths.rc Fixing qp_export 2019-01-26 01:48:32 +01:00
qp.rc Develop (#10) 2019-02-22 19:19:58 +01:00
README.rst Initial commit 2019-01-25 11:39:31 +01:00

README.rst 

This directory contains all the files to be sourced when the |QP| environment is loaded.