Emmanuel Giner a0d5869054 Modifs of fobo-scf

2016-07-16 16:09:50 +02:00

..

EZFIO.cfg

begin DFT in qp

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grid_density.irp.f

Modifs of fobo-scf

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integration_3d.irp.f

Modifs of fobo-scf

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integration_radial.irp.f

Modifs of fobo-scf

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NEEDED_CHILDREN_MODULES

begin DFT in qp

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routines_roland.irp.f

begin DFT in qp

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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