beauty:2020
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beauty:2020 [2020/12/10 17:29] – [Removal of files file mention] Xavier Gonze | beauty:2020 [2020/12/10 18:51] – [Remove superfluous variables] Xavier Gonze | ||
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Then gauge what is to be done : | Then gauge what is to be done : | ||
- First visualize the current status of your tutorial, using ./mksite.py serve, which needs [[beauty: | - First visualize the current status of your tutorial, using ./mksite.py serve, which needs [[beauty: | ||
- | - Look at an example : the first basic tutorial, first from the Web, < | + | - Look at an example : the first basic tutorial, first from the Web, < |
Then beautify the tutorial. The five first steps might induce modification of the input files and reference output files. In order to save your (human) time, | Then beautify the tutorial. The five first steps might induce modification of the input files and reference output files. In order to save your (human) time, | ||
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==== Adjust input variables ==== | ==== Adjust input variables ==== | ||
As an example, in tbase1_3.abi, | As an example, in tbase1_3.abi, | ||
- | So toldff has been replaced by tolrff... | + | So toldff has been replaced by tolrff. |
==== Structure the input files according to a model ==== | ==== Structure the input files according to a model ==== | ||
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==== Remove superfluous variables ==== | ==== Remove superfluous variables ==== | ||
- | This did not happen | + | |
+ | No superfluous input variable has been removed | ||
+ | |||
+ | Still, | ||
if several of them share exactly the same set of atoms and their positions. | if several of them share exactly the same set of atoms and their positions. | ||
In this case, think using the " | In this case, think using the " | ||
+ | |||
+ | Well, this might have been possible in the tbase1 tutorial, but after consideration, | ||
==== Remove the use of ixc ==== | ==== Remove the use of ixc ==== | ||
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While redoing the tutorial step-by-step, | While redoing the tutorial step-by-step, | ||
- | ==== Change | + | ==== Change file suffixes ==== |
Change the input file suffix from .in to .abi, and the output file suffix from .out to .abo . In the tbase1_1.md file, this was needed at numerous places, in the main text, but also in the dialog boxes : | Change the input file suffix from .in to .abi, and the output file suffix from .out to .abo . In the tbase1_1.md file, this was needed at numerous places, in the main text, but also in the dialog boxes : | ||
replacing | replacing | ||
{% dialog tests/ | {% dialog tests/ | ||
- | | ||
by | by | ||
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Going through it for the first time might be 15-20 minutes. | Going through it for the first time might be 15-20 minutes. | ||
- | Training might be another 15 minutes (e.g. starting the server with '' | + | Training might be another 15 minutes (e.g. first '' |
then trying to make some fake modifications). | then trying to make some fake modifications). | ||
beauty/2020.txt · Last modified: 2020/12/11 09:04 by Xavier Gonze