i-pi-dev_archive
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Improving documentation
Let's try to gather in this post all the problem regarding the documentation: inconsistency, points that need clarifications... and so on.
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[ ] Units of input files(#164): the only documentation regarding the string used as the values for
and must be divined from the first tutorial in the manual. Should be MUCH more systematic: each possible string should be contained in a table with all the associated default behavior plus a general comment on how to set units of the input files. -
[ ] Document the default behavior of the replay mode if no "CELL" is specified in the trajectory file that it is reading (can be a problem for manually made trajectory files in periodic cases, if users don't know). Any other default behaviors of the replay mode that should be better documented? (MR)