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Octopus
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Modules | |
module | xc_vdw_oct_m |
A module that takes care of xc contribution from vdW interactions. | |
Data Types | |
type | xc_vdw_oct_m::xc_vdw_t |
Functions/Subroutines | |
subroutine | xc_vdw_oct_m::xc_vdw_init (this, namespace, space, gr, xc, ions, x_id, c_id) |
subroutine | xc_vdw_oct_m::xc_vdw_end (this) |
subroutine | xc_vdw_oct_m::xc_vdw_calc (this, namespace, space, latt, atom, natoms, pos, gr, st, energy, vxc) |