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QuantumPackage/src/utils
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Anthony Scemama de3b42551f
Merge pull request #234 from eginer/dev 
added the possibility of point charges in the Hamiltonian
2023-01-19 17:03:29 +01:00
..
angular_integration.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
block_diag_degen.irp.f
opt-g added
2022-12-05 00:08:00 +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
cgtos_one_e.irp.f
forked v
2022-07-05 01:17:43 +02:00
cgtos_utils.irp.f
forked v
2022-07-05 01:17:43 +02:00
constants.include.F
Merging with master
2022-11-29 11:54:12 +01:00
cpx_erf.irp.f
forked v
2022-07-05 01:17:43 +02:00
extrapolation.irp.f
Linear dependencies cutoff
2020-05-25 11:31:28 +02:00
EZFIO.cfg
forked v
2022-07-05 01:17:43 +02:00
format_w_error.irp.f
Merge dev
2022-11-30 10:18:41 +01:00
fortran_mmap.c
Initial commit
2019-01-25 11:39:31 +01:00
integration.irp.f
fixed bug in vectorized integ
2022-12-10 14:14:45 +01:00
intel.f90
Sorting compatible with old IPP
2021-05-31 12:16:00 +02:00
linear_algebra.irp.f
bugfix in restore_symmetry
2023-01-18 09:05:16 +01:00
loc.f
Removed labels in loc.f
2022-11-19 16:16:04 +01:00
map_functions.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
map_module.f90
C quicksort
2022-05-01 14:27:16 +02:00
memory.irp.f
Merging with master
2022-11-29 11:54:12 +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
fixed bug in vectorized integ
2022-12-10 14:14:45 +01:00
prim_in_r.irp.f
Fixed division by zero in RSDFT
2020-05-20 11:45:41 +02:00
qsort_module.f90
Revert sort from C quicksort
2022-12-07 18:19:38 +01:00
qsort.c
Revert sort from C quicksort
2022-12-07 18:19:38 +01:00
qsort.org
Revert sort from C quicksort
2022-12-07 18:19:38 +01:00
README.rst
Initial commit
2019-01-25 11:39:31 +01:00
set_multiple_levels_omp.irp.f
Merging with master
2022-11-29 11:54:12 +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
Revert sort from C quicksort
2022-12-07 18:19:38 +01:00
transpose.irp.f
Initial commit
2019-01-25 11:39:31 +01:00
units.irp.f
Merge dev
2022-11-30 10:18:41 +01:00
util.irp.f
Merge dev
2022-11-30 10:18:41 +01:00

README.rst 

=====
utils
=====

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