LCPQ/qp2
9
1
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2025-02-09 18:24:14 +01:00
Code Releases Activity
qp2/src/utils
History
Emmanuel Giner 26177b12ca fixed bug in give_explicit_poly_and_gaussian
2021-06-28 11:52:06 +02:00
..
angular_integration.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
c_funcs.c
Removed internal reads in zmq
2021-03-31 13:36:42 +02:00
c_functions.f90
Removed internal reads in zmq
2021-03-31 13:36:42 +02:00
constants.include.F
fixed two rdms
2021-06-03 14:57:45 +02:00
extrapolation.irp.f
Linear dependencies cutoff
2020-05-25 11:31:28 +02:00
EZFIO.cfg
forgot file
2021-05-16 11:24:05 +02:00
fortran_mmap.c
Initial commit
2019-01-25 11:39:31 +01:00
integration.irp.f
fixed bug in give_explicit_poly_and_gaussian
2021-06-28 11:52:06 +02:00
intel.f90
Sorting compatible with old IPP
2021-05-31 12:16:00 +02:00
linear_algebra.irp.f
fixed two rdms
2021-06-03 14:57:45 +02:00
map_functions.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
map_module.f90
Initial commit
2019-01-25 11:39:31 +01:00
memory.irp.f
Don't recompute 1st Davidson iteration
2019-11-18 15:56:26 +01:00
mmap.f90
Initial commit
2019-01-25 11:39:31 +01:00
NEED
Initial commit
2019-01-25 11:39:31 +01:00
one_e_integration.irp.f
merged alors
2020-11-08 18:27:57 +01:00
prim_in_r.irp.f
Fixed division by zero in RSDFT
2020-05-20 11:45:41 +02:00
README.rst
Initial commit
2019-01-25 11:39:31 +01:00
shank.irp.f
added the possibility to use no_vvvv integrals from EZFIO
2020-05-11 16:04:16 +02:00
sort.irp.f
Removed OMP in sorting
2021-05-31 19:02:25 +02:00
transpose.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
util.irp.f
minor modifs
2020-09-21 15:38:26 +02:00

README.rst 

=====
utils
=====

Contains general purpose utilities (sorting, maps, etc).