From 1aab926b66cb6c3589630ad92dcb17b1f8ad2bed Mon Sep 17 00:00:00 2001 From: Emmanuel Giner Date: Tue, 7 Apr 2020 12:19:17 +0200 Subject: [PATCH] beginning to reorganise stuffs --- src/dft_one_e/NEED | 2 +- src/{dft_utils_one_e => dft_one_e}/effective_pot.irp.f | 0 src/{dft_utils_one_e => dft_one_e}/mu_erf_dft.irp.f | 0 src/{dft_utils_one_e => dft_one_e}/one_e_energy_dft.irp.f | 0 src/{dft_utils_one_e => dft_one_e}/sr_coulomb.irp.f | 0 src/{dft_utils_one_e => dft_utils_func}/NEED | 0 src/{dft_utils_one_e => dft_utils_func}/README.rst | 0 src/{dft_utils_one_e => dft_utils_func}/garbage_func.irp.f | 0 src/{ecmd_utils => dft_utils_func}/on_top_from_ueg.irp.f | 0 src/{dft_utils_one_e => dft_utils_func}/rho_ab_to_rho_tot.irp.f | 0 .../routines_exc_sr_lda.irp.f | 0 .../routines_exc_sr_pbe.irp.f | 0 src/{dft_utils_one_e => dft_utils_func}/utils.irp.f | 0 src/dummy/NEED | 2 +- src/functionals/NEED | 2 +- 15 files changed, 3 insertions(+), 3 deletions(-) rename src/{dft_utils_one_e => dft_one_e}/effective_pot.irp.f (100%) rename src/{dft_utils_one_e => dft_one_e}/mu_erf_dft.irp.f (100%) rename src/{dft_utils_one_e => dft_one_e}/one_e_energy_dft.irp.f (100%) rename src/{dft_utils_one_e => dft_one_e}/sr_coulomb.irp.f (100%) rename src/{dft_utils_one_e => dft_utils_func}/NEED (100%) rename src/{dft_utils_one_e => dft_utils_func}/README.rst (100%) rename src/{dft_utils_one_e => dft_utils_func}/garbage_func.irp.f (100%) rename src/{ecmd_utils => dft_utils_func}/on_top_from_ueg.irp.f (100%) rename src/{dft_utils_one_e => dft_utils_func}/rho_ab_to_rho_tot.irp.f (100%) rename src/{dft_utils_one_e => dft_utils_func}/routines_exc_sr_lda.irp.f (100%) rename src/{dft_utils_one_e => dft_utils_func}/routines_exc_sr_pbe.irp.f (100%) rename src/{dft_utils_one_e => dft_utils_func}/utils.irp.f (100%) diff --git a/src/dft_one_e/NEED b/src/dft_one_e/NEED index 2f95a965..377e4ba0 100644 --- a/src/dft_one_e/NEED +++ b/src/dft_one_e/NEED @@ -1,2 +1,2 @@ -dft_utils_one_e +dft_utils_func functionals diff --git a/src/dft_utils_one_e/effective_pot.irp.f b/src/dft_one_e/effective_pot.irp.f similarity index 100% rename from src/dft_utils_one_e/effective_pot.irp.f rename to src/dft_one_e/effective_pot.irp.f diff --git a/src/dft_utils_one_e/mu_erf_dft.irp.f b/src/dft_one_e/mu_erf_dft.irp.f similarity index 100% rename from src/dft_utils_one_e/mu_erf_dft.irp.f rename to src/dft_one_e/mu_erf_dft.irp.f diff --git a/src/dft_utils_one_e/one_e_energy_dft.irp.f b/src/dft_one_e/one_e_energy_dft.irp.f similarity index 100% rename from src/dft_utils_one_e/one_e_energy_dft.irp.f rename to src/dft_one_e/one_e_energy_dft.irp.f diff --git a/src/dft_utils_one_e/sr_coulomb.irp.f b/src/dft_one_e/sr_coulomb.irp.f similarity index 100% rename from src/dft_utils_one_e/sr_coulomb.irp.f rename to src/dft_one_e/sr_coulomb.irp.f diff --git a/src/dft_utils_one_e/NEED b/src/dft_utils_func/NEED similarity index 100% rename from src/dft_utils_one_e/NEED rename to src/dft_utils_func/NEED diff --git a/src/dft_utils_one_e/README.rst b/src/dft_utils_func/README.rst similarity index 100% rename from src/dft_utils_one_e/README.rst rename to src/dft_utils_func/README.rst diff --git a/src/dft_utils_one_e/garbage_func.irp.f b/src/dft_utils_func/garbage_func.irp.f similarity index 100% rename from src/dft_utils_one_e/garbage_func.irp.f rename to src/dft_utils_func/garbage_func.irp.f diff --git a/src/ecmd_utils/on_top_from_ueg.irp.f b/src/dft_utils_func/on_top_from_ueg.irp.f similarity index 100% rename from src/ecmd_utils/on_top_from_ueg.irp.f rename to src/dft_utils_func/on_top_from_ueg.irp.f diff --git a/src/dft_utils_one_e/rho_ab_to_rho_tot.irp.f b/src/dft_utils_func/rho_ab_to_rho_tot.irp.f similarity index 100% rename from src/dft_utils_one_e/rho_ab_to_rho_tot.irp.f rename to src/dft_utils_func/rho_ab_to_rho_tot.irp.f diff --git a/src/dft_utils_one_e/routines_exc_sr_lda.irp.f b/src/dft_utils_func/routines_exc_sr_lda.irp.f similarity index 100% rename from src/dft_utils_one_e/routines_exc_sr_lda.irp.f rename to src/dft_utils_func/routines_exc_sr_lda.irp.f diff --git a/src/dft_utils_one_e/routines_exc_sr_pbe.irp.f b/src/dft_utils_func/routines_exc_sr_pbe.irp.f similarity index 100% rename from src/dft_utils_one_e/routines_exc_sr_pbe.irp.f rename to src/dft_utils_func/routines_exc_sr_pbe.irp.f diff --git a/src/dft_utils_one_e/utils.irp.f b/src/dft_utils_func/utils.irp.f similarity index 100% rename from src/dft_utils_one_e/utils.irp.f rename to src/dft_utils_func/utils.irp.f diff --git a/src/dummy/NEED b/src/dummy/NEED index c1d788cf..3d5eb1f7 100644 --- a/src/dummy/NEED +++ b/src/dummy/NEED @@ -15,7 +15,7 @@ density_for_dft determinants dft_keywords dft_utils_in_r -dft_utils_one_e +dft_utils_func dressing electrons ezfio_files diff --git a/src/functionals/NEED b/src/functionals/NEED index d81183d0..a0eb2778 100644 --- a/src/functionals/NEED +++ b/src/functionals/NEED @@ -1 +1 @@ -dft_utils_one_e +dft_utils_func