miFit: add a dialogue to read_cif(formulae) -> sqw_phonons

McStasMcXtrace / iFit

a simple library to analyze data (with McCode and Phonons/DFT hooks). :warning: this project has been moved to https://gitlab.com/soleil-data-treatment/soleil-software-projects/remote-desktop

http://ifit.mccode.org

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miFit: add a dialogue to read_cif(formulae) -> sqw_phonons #139

Closed farhi closed 6 years ago

farhi commented 6 years ago

Add a specific 'configuration' menu item for Phonons to request a chemical formulae:

inputdlg(formulae) with Hill system: C, then H, then alpha order
cif - read_cif(formulae)
sqw_phonons(cif)

farhi commented 6 years ago

done with commit https://github.com/McStasMcXtrace/iFit/commit/8f3751f9623f011cf70eedf11ef096d8c997b135