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quantum_package/plugins/DFT_Utils
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Emmanuel Giner a0d5869054 Modifs of fobo-scf
2016-07-16 16:09:50 +02:00
..
EZFIO.cfg begin DFT in qp 2016-04-17 23:30:04 +02:00
grid_density.irp.f Modifs of fobo-scf 2016-07-16 16:09:50 +02:00
integration_3d.irp.f Modifs of fobo-scf 2016-07-16 16:09:50 +02:00
integration_radial.irp.f Modifs of fobo-scf 2016-07-16 16:09:50 +02:00
NEEDED_CHILDREN_MODULES begin DFT in qp 2016-04-17 23:30:04 +02:00
routines_roland.irp.f begin DFT in qp 2016-04-17 23:30:04 +02:00
test_integration_3d_density.irp.f Integration for DFT seems to be ok, but need to improve the angular part 2016-04-21 23:59:50 +02:00