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Committer:
Nick Papior
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Date:
2016-04-29 07:31:13 UTC
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mfrom:
(484.1.15 ldau-devel)
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Revision ID:
nickpapior@gmail.com-20160429073113-l1lmerrqcoa1oqey
Enabled LDA+U in siesta
- Conversion of the previous implementation to the trunk version
This version has been implemented by Javier Junquera
added:
Src/ldau.F
Src/ldau_specs.f
modified:
Docs/siesta.tex
Src/Makefile
Src/atm_transfer.f
Src/atm_types.f
Src/atmfuncs.f
Src/atom.F
Src/basis_io.F
Src/basis_specs.f
Src/basis_types.f
Src/broadcast_basis.F
Src/compute_energies.F90
Src/compute_max_diff.F
Src/final_H_f_stress.F
Src/hsparse.F
Src/initatom.f
Src/m_energies.F90
Src/matel_registry.F90
Src/register_rfs.F90
Src/scfconvergence_test.F
Src/setup_hamiltonian.F
Src/siesta_init.F
Src/write_subs.F