- 07 May, 2021 9 commits
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juan rodriguez-carvajal authored
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juan rodriguez-carvajal authored
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juan rodriguez-carvajal authored
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Elisa Rebolini authored
compil option to disable Qparallel See merge request !15
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juan rodriguez-carvajal authored
Changing the names of source files to have the same name as the corresponding module. Only those that depend on the compiler have not been changed (eg. CFML_GlobalDeps).
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Elisa Rebolini authored
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Elisa Rebolini authored
Feature python api powder diffraction See merge request !14
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Elisa Rebolini authored
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- 06 May, 2021 1 commit
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Ross JOHN ANGEL authored
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- 01 May, 2021 3 commits
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juan rodriguez-carvajal authored
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juan rodriguez-carvajal authored
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juan rodriguez-carvajal authored
Eliminating the sub-directory Program_Examples/CFML_Groups that has been moved to FullProf/Src in ProgCMFL, because it contains Fortran 2003-2008 instructions that are not in CrysFML. This directory will be superseded by the new library CrysFML08 as soon as it is operational.
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- 30 Apr, 2021 2 commits
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juan rodriguez-carvajal authored
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juan rodriguez-carvajal authored
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- 29 Apr, 2021 3 commits
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Elisa Rebolini authored
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Elisa Rebolini authored
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Elisa Rebolini authored
getters for multiple phases + nref in reflection list + correct initialisation of job info for cif files
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- 28 Apr, 2021 3 commits
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Elisa Rebolini authored
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Elisa Rebolini authored
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Elisa Rebolini authored
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- 27 Apr, 2021 3 commits
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Elisa Rebolini authored
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nebil a. katcho authored
When bvel calculations are performed, the site energy for the mobile species is computed and the energies are displayed in the bvs file.
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Elisa Rebolini authored
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- 25 Apr, 2021 2 commits
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juan rodriguez-carvajal authored
Completing the change made by Ross last time in CFML_Cryst_Types.f90. Changes in select case construct of Get_Cryst_Orthog_Matrix and Get_Deriv_Orth_Cell were needed.
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Elisa Rebolini authored
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- 23 Apr, 2021 3 commits
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Elisa Rebolini authored
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Elisa Rebolini authored
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Elisa Rebolini authored
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- 22 Apr, 2021 1 commit
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Elisa Rebolini authored
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- 19 Apr, 2021 1 commit
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Elisa Rebolini authored
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- 12 Apr, 2021 1 commit
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Ross JOHN ANGEL authored
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- 08 Apr, 2021 4 commits
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Ross JOHN ANGEL authored
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https://code.ill.fr/scientific-software/crysfmlRoss JOHN ANGEL authored
# Conflicts: # Src/CFML_EoS_Mod.f90
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Ross JOHN ANGEL authored
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Javier Gonzalez-Platas authored
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- 04 Apr, 2021 1 commit
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Remi Perenon authored
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- 03 Apr, 2021 1 commit
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Remi Perenon authored
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- 02 Apr, 2021 2 commits
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Javier Gonzalez-Platas authored
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