Martin Diehl
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23c6510faa
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atol=0.0 is fine
crystallite takes max(atol, rtol*X), so atol=0.0 means that convergence
is based on rtol only
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2020-03-16 00:52:18 +01:00 |
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Martin Diehl
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16e23b113a
|
no need to set optional parameters to default values
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2020-03-15 19:00:02 +01:00 |
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Vitesh Shah
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be387ab8cf
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atol_shear and atol_twinfrac are not allowed to be zero
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2019-03-29 11:36:30 +00:00 |
|
Vitesh Shah
|
c60ec4c490
|
c/a ratio matches the lattice_init name
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2019-03-29 11:30:00 +00:00 |
|
Martin Diehl
|
638789b111
|
totalvolfrac and totalshear don't exist anymore
use postprocessing tools if needed
|
2018-11-25 16:16:46 +01:00 |
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Martin Diehl
|
95182dac79
|
avoid windows name conflict + and (hopefully) more descriptive name and location
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2016-07-18 11:20:23 +02:00 |