Commit Graph

5396 Commits

Author SHA1 Message Date
Martin Diehl 31ea4dadf1 IO_stringPos replacement not needing MAXNCHUNKS but making use of new Fortran features for dynamic allocation 2015-08-13 14:54:34 +00:00
Martin Diehl 7ca1e77495 bug fixing 2015-08-13 08:32:09 +00:00
Philip Eisenlohr f982f42839 convert TSL/EDAX ang file format to proper ASCIItable. 2015-08-12 22:14:19 +00:00
Philip Eisenlohr 1976cf44c1 fixed os.path.splitext bug when using STDIN input 2015-08-12 21:56:37 +00:00
Philip Eisenlohr 3e65c324de adopted changes in ASCIItable API 2015-08-12 21:52:33 +00:00
Philip Eisenlohr dfbd2fd013 fixed bug for STDIN processing 2015-08-12 21:28:07 +00:00
Martin Diehl 1149053c61 updated to new ASCII table style 2015-08-12 20:59:10 +00:00
Philip Eisenlohr 9ee49b2c3b adopted recent changes to API in ASCIItable.
removed Voronoi method from core module.
fixed buggy Laguerre tessellation (wrong seed scaling, wrong x,y,z order)
2015-08-12 20:55:53 +00:00
Martin Diehl 0217abf66a updated references for testing 2015-08-12 20:45:39 +00:00
Philip Eisenlohr 8217fdb115 adopted recent changes to API in ASCIItable. 2015-08-12 18:56:40 +00:00
Martin Diehl 31a6ac328d adjusted to new ASCII table style and bugfix 2015-08-12 18:53:39 +00:00
Martin Diehl 4da8cc5f40 updated reference to fixed number of decimal places 2015-08-12 18:51:04 +00:00
Martin Diehl 22c52fbd32 cleaned core module 2015-08-12 18:48:09 +00:00
Philip Eisenlohr cd70ec5a38 adopted recent changes to API in ASCIItable. 2015-08-12 18:43:11 +00:00
Philip Eisenlohr 93dd9f5c09 bug fix regarding self.tmpext.
added check for access rights when overwriting original file.
2015-08-12 18:41:44 +00:00
Martin Diehl a29240242b standard name for numpy is np 2015-08-12 18:32:28 +00:00
Philip Eisenlohr cd9a802a2b adoption of recent API change in ASCIItable. 2015-08-12 18:09:40 +00:00
Philip Eisenlohr 5dad5df588 adoption of recent API change in ASCIItable. 2015-08-12 17:47:38 +00:00
Philip Eisenlohr 3097c87bea adoption of recent API change in ASCIItable. 2015-08-12 17:43:49 +00:00
Philip Eisenlohr 64515d7aca simplified interface:
name == None: read from stdin
outname == None and not readonly mode: do in-place substitution of name (with transparent file renaming upon table.close)
2015-08-12 17:42:38 +00:00
Martin Diehl f9348398ce removed old file, added possibility to normalise euler angels to standard range, added svn properties 2015-08-12 15:15:33 +00:00
Martin Diehl 35863e0229 fixed averageDown and made it's test running 2015-08-12 13:43:05 +00:00
Martin Diehl 36caddcc24 adjusted to new ASCII table file handling 2015-08-12 12:51:47 +00:00
Martin Diehl 77d0cf8612 removed non-openMP tests 2015-08-11 11:01:36 +00:00
Chen Zhang 3991813595 fix syntax error regarding several static method 2015-08-10 21:08:00 +00:00
Martin Diehl bceeb0964c corrected calculation of expected file size for legacy files beyond the 4 GB limit 2015-08-10 18:48:48 +00:00
Martin Diehl a327e0c944 folder was double (move did not work properly) 2015-08-10 17:29:30 +00:00
Tias Maiti 126cea24ce fixed syntax and undefined variable calling errors 2015-08-09 22:12:49 +00:00
Philip Eisenlohr 57dfa6a87e added fall-back to non-multithreading execution when using only single CPU. 2015-08-08 21:43:21 +00:00
Philip Eisenlohr 31f6d22d89 added option (force) to override selective seeding check. 2015-08-08 20:20:53 +00:00
Philip Eisenlohr 889a5807bb more conservative (and probably appropriate) variance default for Laguerre tessellations: 1.0 —> 0.1 2015-08-08 20:12:26 +00:00
Philip Eisenlohr bbeb210708 functionality now provided by more general “geom_fromImage” 2015-08-07 22:16:40 +00:00
Philip Eisenlohr 9729c03c00 removed obsolete code. added croak about number of cpus used. 2015-08-07 22:15:24 +00:00
Philip Eisenlohr a4772343b0 adopted new ASCIItable API. some polishing. 2015-08-07 22:08:54 +00:00
Tias Maiti 4ed56a8ba6 removed debugging print statements 2015-08-07 20:52:57 +00:00
Philip Eisenlohr d4e748b654 outsourced multiple repetitive functions into ASCIItable class.
changed ASCIItable API from file-handles to filenames.

adopted these changes in pre and post processing scripts.

unified behavior and look.

fixed bugs here and there.

improved functionality.
2015-08-07 19:03:26 +00:00
Martin Diehl 563d9e64dd MAXNCHUNKS capitalized since it is a parameter 2015-08-06 09:24:56 +00:00
Pratheek Shanthraj 3d94ae4074 finite strain correction for respective expansions 2015-08-05 14:12:54 +00:00
Tias Maiti 09c7affbbc more efficient rate calculation in updateState when subdt is zero 2015-08-05 11:09:38 +00:00
Tias Maiti 7928ce3ac3 fixed erroneous rate calculation in updateState when time increment (subdt) was zero during initialization. 2015-08-04 21:27:30 +00:00
Tias Maiti 65d114e4f0 improved debug statements 2015-08-04 21:26:22 +00:00
Chen Zhang dfe0991134 adding property alias for Orientation class to simplify syntax. 2015-08-04 20:38:06 +00:00
Pratheek Shanthraj 905b9f8f42 petsc update (now v3.6.1) 2015-08-04 15:04:53 +00:00
Pratheek Shanthraj 5b57ea7d16 fluctuations proportional to thermal equilibrium concentration 2015-08-03 11:08:59 +00:00
Pratheek Shanthraj a01d7d8d66 corrections to crystallite_push33ToRef function 2015-08-03 11:07:19 +00:00
Chen Zhang 1ec3639cf1 use pure python implementation of orientation class as default 2015-08-02 17:49:38 +00:00
Pratheek Shanthraj 1ed276ce2d quadratic softening for finite dissipation energy 2015-07-30 10:29:25 +00:00
Tias Maiti de90a04374 assign indices from microstructure column if present for laguerre tessellation 2015-07-30 04:42:00 +00:00
Chen Zhang fbb7f9b11b remove deprecated function from math.f90 2015-07-29 20:49:42 +00:00
Chen Zhang 9287d6f15f make the interface for Symmetry class compatible with pure python version. 2015-07-29 19:39:30 +00:00