Commit Graph

5254 Commits

Author SHA1 Message Date
Luv Sharma 1df2db7433 Right hand side is residual and not zero, which made residual dependent on timeinc. Now corrected. 2015-07-06 08:33:48 +00:00
Martin Diehl 72b7df34a3 save some space 2015-07-02 09:45:25 +00:00
Aritra Chakraborty 74af77a81f formatted the interaction matrix for beta-Sn 2015-07-02 05:45:56 +00:00
Aritra Chakraborty 0e6ac411bb further modified to add longer lines for (bct) beta-Sn in lattice 2015-07-02 05:44:45 +00:00
Martin Diehl 6272129f01 formatted code and modified Makefile to have long lines in lattice 2015-07-02 05:09:07 +00:00
Philip Eisenlohr c0dd3ad466 exchanged “geom_fromAng” with “geom_fromTable”. 2015-07-01 16:37:01 +00:00
Philip Eisenlohr 812d17f91c streamlined column processing based on recently introduced asciitable functionality. 2015-07-01 15:48:34 +00:00
Martin Diehl ef243d3e19 added references 2015-06-30 14:52:48 +00:00
Martin Diehl ee6495ad68 adding logfile to deployed repository 2015-06-29 19:53:33 +00:00
Yannick Naunheim 5fe65bfcc3 corrected OR models and set up simple test to check them 2015-06-29 16:02:56 +00:00
Haiming Zhang 61e3987bfa extract the deformation anisotropic coefficients (r values) and strength anisotropic coefficients (normalized yield stress) automatically. 2015-06-29 15:57:31 +00:00
Philip Eisenlohr 47249bb52a added possibility to scale deformation fluctuation field. 2015-06-29 09:44:49 +00:00
Philip Eisenlohr fcdd80bba3 switched order of command line options to make consequence of “degrees” switch more clear, i.e., it affects both the tolerance and Euler angles… 2015-06-29 09:40:44 +00:00
Aritra Chakraborty e61050dcde added lattice for (bct) beta- Sn. 2015-06-27 14:55:30 +00:00
Philip Eisenlohr 129026662c fixed small bugs.
modernized file treatment.
improved Laguerre speed by a factor of 2 due to precalculating the squared weights.
2015-06-27 08:41:08 +00:00
Martin Diehl 50bcfe6e0d possibility to give fixed seed to random orientation 2015-06-26 06:32:25 +00:00
Martin Diehl 6aaf074651 bug fix 2015-06-25 16:16:01 +00:00
Haiming Zhang 088299daf2 fix the bug in the calculation of RMSD, replace N with sqrt(N). 2015-06-25 12:41:26 +00:00
Martin Diehl f10dfa311a fixed ORs 2015-06-25 12:00:08 +00:00
Franz Roters 81e09cabee updated some slides 2015-06-23 17:46:31 +00:00
Shaokang Zhang a40d247f7f lower bound for damage is residual stiffness 2015-06-22 14:27:32 +00:00
Su Leen Wong 12bc4f01ef fcc to hex orientation relationship (Shoji-Nishiyama) 2015-06-22 13:47:15 +00:00
Su Leen Wong ad17c40d92 Renamed variables to denote fcc to bcc transformation 2015-06-22 08:33:48 +00:00
Su Leen Wong 5114e0b43e Cleaning up 2015-06-22 08:10:20 +00:00
Philip Eisenlohr 2d8af638b0 added optional keyword `degrees´ to q.asEulers().
added methods inFZ, equivalentQuaternions, and equivalentOrientations to Orientation class.
general polishing…
2015-06-21 12:05:17 +00:00
Philip Eisenlohr e310763c52 Novel script to generate geometry description and material configuration from position, phase, and orientation data in an ASCIItable.
Can deal with phase-specific lattice symmetry, condenses orientations within a given angular threshold, and might be used in lieu of geom_fromANG when replacing the ANG header.
2015-06-21 11:56:05 +00:00
Philip Eisenlohr 9b1f16e99e report data range.
gracefully deal with constant field (below 1e-8 noise).
2015-06-19 11:36:21 +00:00
Philip Eisenlohr 3e0e187b14 clarified meaning of symEulers function in help 2015-06-19 07:29:01 +00:00
Philip Eisenlohr 16edd1693d now only trying to close input and output tables.
corrected buggy behavior in case no columns found in data_readArray.
2015-06-19 06:08:09 +00:00
Tias Maiti acad1246f3 fixed wrong variable name for quaternions as rotation options 2015-06-19 04:38:00 +00:00
Tias Maiti 94423cc7ac added scriptID line “ removed during last commit” 2015-06-17 19:47:50 +00:00
Tias Maiti 012c830eff removed writing of debugging statement to final output 2015-06-17 19:44:01 +00:00
Franz Roters b1c036daab added some comments on possible code changes 2015-06-17 06:53:00 +00:00
Philip Eisenlohr e440305532 streamlined ASCIItable error checking. 2015-06-17 06:52:43 +00:00
Philip Eisenlohr 5cc7b60a88 simplified processing of ASCIItables by utilizing the improved class methods.
modernized file looping.
2015-06-16 17:21:24 +00:00
Franz Roters 0e48fb8fc7 removed double entry in use list 2015-06-16 07:57:42 +00:00
Philip Eisenlohr d57c7568dd simplified processing of ASCIItables by utilizing the improved class methods.
modernized file looping.
updated help.
2015-06-16 05:42:11 +00:00
Philip Eisenlohr c089ff9256 now with $ID$ and correct line endings… 2015-06-15 18:13:06 +00:00
Philip Eisenlohr 6086baba52 Generate PNG image from scalar data on grid deformed by (periodic) deformation gradient. 2015-06-15 18:12:38 +00:00
Philip Eisenlohr 83547ce29f condensed multiple import statements into general one at module start. 2015-06-15 15:36:58 +00:00
Luv Sharma a5b3e9d64c typos fixed 2015-06-14 05:51:53 +00:00
Philip Eisenlohr 37792f67df automatically figure dimension of labels to tag. 2015-06-13 11:55:20 +00:00
Philip Eisenlohr 66ce1d0b33 speed up for inversePole method. Now only performing symmetry equivalence when asked for SST. 2015-06-13 11:51:10 +00:00
Philip Eisenlohr 0efbd4b11f added Colormap.color(fraction) function to interpolate a color from the colormap.
cleaned Colormap.export by now relying on new interpolation function.
2015-06-13 11:46:32 +00:00
Philip Eisenlohr 3d7dfba40a syntax polishing 2015-06-13 11:43:34 +00:00
Su Leen Wong 081bc33159 Read in c/a ratio for transformed hcp phase 2015-06-12 08:59:39 +00:00
Martin Diehl d894900c2e added support for marc 2014:X 2015-06-11 18:19:52 +00:00
Martin Diehl efc110d8f0 should be version independent 2015-06-11 18:10:52 +00:00
Haiming Zhang c7f59c6482 change angle into radian. 2015-06-11 17:57:23 +00:00
Su Leen Wong a370372c1b transformed lattice structure should not be mandatory 2015-06-11 17:03:34 +00:00