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subroutine, public | pes_oct_m::pes_init (pes, namespace, space, mesh, box, st, save_iter, kpoints, abs_boundaries, ext_partners, max_iter, dt) |
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subroutine, public | pes_oct_m::pes_end (pes) |
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subroutine, public | pes_oct_m::pes_calc (pes, namespace, space, mesh, st, dt, iter, der, kpoints, ext_partners, stopping) |
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subroutine, public | pes_oct_m::pes_output (pes, namespace, space, gr, st, iter, outp, dt, ions) |
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subroutine, public | pes_oct_m::pes_dump (pes, namespace, restart, st, mesh, ierr) |
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subroutine, public | pes_oct_m::pes_load (pes, namespace, restart, st, ierr) |
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subroutine, public | pes_oct_m::pes_init_write (pes, mesh, st, namespace) |
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