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Active
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master
default
protected
f7d626c6
·
Added the ability to gracefully shutdown RASSCF by creating a 'STOP' file in...
·
Sep 13, 2019
tempkrig
05919af5
·
numHess checked
·
Sep 11, 2019
dev/veryazov
f7be337c
·
fix for MSYM compilation suggested by IFG
·
Sep 11, 2019
kriging
a4c9fefe
·
Update printout in Slapaf to reflect kriging options.
·
Sep 10, 2019
rotatory
51bf75e9
·
Rotatory strength tensor for SO states
·
Sep 06, 2019
RasOrb_py_parsers
b23cb69d
·
MAINT: reindex + copy method added
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Aug 28, 2019
auto_stoch_GASSCF
45214bf5
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MAINT: correct unsused procedure
·
Aug 27, 2019
dev/external
b0dc7df3
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Merge remote-tracking branch 'upstream/master' into aniso
·
Aug 23, 2019
sandx_fock
0c741794
·
edit to output Fock in square matrix
·
Jul 12, 2019
dev/josehermida
900e997d
·
Update tests
·
Jul 08, 2019
orville
89768ea5
·
dmrg
·
Jul 04, 2019
dev/azech
6a3a5e39
·
Merge remote-tracking branch 'origin/master' into dev/azech
·
Jun 27, 2019
sandx_grad
d7508c58
·
fix dcopy for intel
·
Jun 25, 2019
mxfile
73e6a892
·
Check MxFile.
·
Jun 04, 2019
OrbSortExpbas_from_master
45ee7443
·
ArtOrb option added... not fully functioning yet
·
Apr 16, 2019
pymolcas_as_library
3ae6ea2c
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ENH: pymolcas_lib added
·
Apr 16, 2019
dyson
6ef1aae0
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Experimental implementation of symmetry support for Dyson calculations.
·
Jan 18, 2019
integral_export
c9b762dc
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Commit not to be merged!
·
Jan 18, 2019
patch-2
1785ef7c
·
Added ANO-XS test to basis.input
·
Dec 13, 2018
rassi_sparse
97adc19f
·
Merge branch 'master' into rassi_sparse
·
Dec 10, 2018
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