From 028b56d0409d2d2fbef2329c9afeff618590cbd9 Mon Sep 17 00:00:00 2001 From: Thomas Applencourt Date: Fri, 3 Jul 2015 14:32:22 +0200 Subject: [PATCH] Remove Ezfio_files/README.rst to git. Change to many time --- plugins/loc_cele/README.rst | 2 +- src/Ezfio_files/.gitignore | 3 +- src/Ezfio_files/README.rst | 140 ------------------------------------ 3 files changed, 3 insertions(+), 142 deletions(-) delete mode 100644 src/Ezfio_files/README.rst diff --git a/plugins/loc_cele/README.rst b/plugins/loc_cele/README.rst index 2db141ee..c2bd983d 100644 --- a/plugins/loc_cele/README.rst +++ b/plugins/loc_cele/README.rst @@ -8,7 +8,7 @@ Documentation This program performs a localization of the active orbitals of a CASSCF wavefunction, reading the orbitals from a RASORB file of molcas. - id1=max number of MO in a given symmetry. + id1=max is the number of MO in a given symmetry. Needed Modules ============== diff --git a/src/Ezfio_files/.gitignore b/src/Ezfio_files/.gitignore index 85ad9d4e..24230463 100644 --- a/src/Ezfio_files/.gitignore +++ b/src/Ezfio_files/.gitignore @@ -9,4 +9,5 @@ Makefile.depend build.ninja .ninja_log .ninja_deps -ezfio_interface.irp.f \ No newline at end of file +ezfio_interface.irp.f +README.rst \ No newline at end of file diff --git a/src/Ezfio_files/README.rst b/src/Ezfio_files/README.rst deleted file mode 100644 index b0570428..00000000 --- a/src/Ezfio_files/README.rst +++ /dev/null @@ -1,140 +0,0 @@ -================== -Ezfio_files Module -================== - -This modules essentially contains the name of the EZFIO directory in the -``ezfio_filename`` variable. This is read as the first argument of the -command-line, or as the ``QPACKAGE_INPUT`` environment variable. -Documentation -============= - -.. Do not edit this section. It was auto-generated from the -.. by the `update_README.py` script. - -`ezfio_filename `_ - Name of EZFIO file. It is obtained from the QPACKAGE_INPUT environment - variable if it is set, or as the 1st argument of the command line. - - -`getunitandopen `_ - :f: - file name - .br - :mode: - 'R' : READ, UNFORMATTED - 'W' : WRITE, UNFORMATTED - 'r' : READ, FORMATTED - 'w' : WRITE, FORMATTED - 'a' : APPEND, FORMATTED - 'x' : READ/WRITE, FORMATTED - .br - - -`output_ao_basis `_ - Output file for AO_Basis - - -`output_bitmask `_ - Output file for Bitmask - - -`output_casino `_ - Output file for Casino - - -`output_cpu_time_0 `_ - Initial CPU and wall times when printing in the output files - - -`output_determinants `_ - Output file for Determinants - - -`output_electrons `_ - Output file for Electrons - - -`output_ezfio_files `_ - Output file for Ezfio_files - - -`output_full_ci `_ - Output file for Full_CI - - -`output_generators_full `_ - Output file for Generators_full - - -`output_hartree_fock `_ - Output file for Hartree_Fock - - -`output_integrals_bielec `_ - Output file for Integrals_Bielec - - -`output_integrals_monoelec `_ - Output file for Integrals_Monoelec - - -`output_loc_cele `_ - Output file for loc_cele - - -`output_mo_basis `_ - Output file for MO_Basis - - -`output_moguess `_ - Output file for MOGuess - - -`output_molden `_ - Output file for Molden - - -`output_nuclei `_ - Output file for Nuclei - - -`output_perturbation `_ - Output file for Perturbation - - -`output_properties `_ - Output file for Properties - - -`output_pseudo `_ - Output file for Pseudo - - -`output_selectors_full `_ - Output file for Selectors_full - - -`output_utils `_ - Output file for Utils - - -`output_wall_time_0 `_ - Initial CPU and wall times when printing in the output files - - -`write_bool `_ - Write an logical value in output - - -`write_double `_ - Write a double precision value in output - - -`write_int `_ - Write an integer value in output - - -`write_time `_ - Write a time stamp in the output for chronological reconstruction - -