Commit Graph

552 Commits

Author SHA1 Message Date
Martin Diehl 0bd8a410ad check all errors, avoid intermediate wait 2020-11-16 09:22:55 +01:00
Martin Diehl e419eea507 read vtr file only by process 1 2020-11-12 14:40:25 +01:00
Martin Diehl bb471cb923 it's a process, not a thread 2020-11-12 07:51:07 +01:00
Martin Diehl cd7ada0da9 use Fortran internals for error handling 2020-11-11 20:09:14 +01:00
Martin Diehl 3dd5eaf1c1 clean exit with stack trace 2020-11-11 14:06:21 +01:00
Martin Diehl 5531f892c3 z = 0 for invalid number of processes
e.g. using 24 processes for a 128x128x128 grid would need 21 processes
with z=6 and 1 process with z=2
2020-11-11 12:47:13 +01:00
Martin Diehl 429c226008 IO is not inherited when using ifort 19
this is intented, public modules should only bring their own functions
and variables into global scope
2020-11-11 12:19:39 +01:00
Martin Diehl b46a25a7d2 C capitalization 2020-11-11 11:47:23 +01:00
Martin Diehl 9119254210 materialpoint => homogenization
especially as prefix for global data (clear name spaces)
2020-10-24 17:26:42 +02:00
Martin Diehl a1ab526456 avoid global variables 2020-10-24 16:01:56 +02:00
Martin Diehl 1c13737935 better readable 2020-10-21 21:12:55 +02:00
Martin Diehl 96243a4ac8 simplifying 2020-10-21 17:46:29 +02:00
Sharan Roongta f25f7ad01e [skip sc] consistent naming convention 2020-10-16 16:17:06 +02:00
Sharan Roongta 3f3a88fdda capitalization 2020-10-15 23:32:38 +02:00
Sharan Roongta 6c79093a75 [skip sc] Fdot --> dotF 2020-10-15 23:22:37 +02:00
Sharan Roongta 6455627af9 accessed by correct dict now; tests improved 2020-10-15 18:09:45 +02:00
Sharan Roongta 1c911f6213 simplified 2020-10-14 17:55:57 +02:00
Sharan Roongta 35fe935088 not used 2020-10-14 13:53:31 +02:00
Sharan Roongta e9ecda7d2e Merge branch 'development' into loadcase.yaml 2020-10-14 13:28:06 +02:00
Sharan Roongta f291166a03 initialisation not needed 2020-10-14 10:53:37 +02:00
Sharan Roongta 1426a35602 loadcase in yaml 2020-10-14 10:31:34 +02:00
Martin Diehl 2db5c9bade geom -> vtr (zero-based) 2020-10-09 22:19:53 +02:00
Martin Diehl cdf3c8cdee Merge remote-tracking branch 'origin/development' into no-crystallite-dPdF 2020-10-03 08:34:02 +02:00
Martin Diehl 7f8613f6ad always update dPdF (was the default anyways) 2020-09-30 10:24:24 +02:00
Martin Diehl 002fe04d35 test for stress ramp 2020-09-26 12:09:45 +02:00
Martin Diehl 32b81770d9 shorter 2020-09-25 21:35:47 +02:00
Martin Diehl 8396af5aec not needed 2020-09-25 15:19:31 +02:00
Martin Diehl 421d4b8f37 forgotten renames 2020-09-25 15:12:56 +02:00
Martin Diehl 8081ed3693 Merge remote-tracking branch 'origin/development' into stress-ramp-loadcase 2020-09-25 15:05:45 +02:00
Philip Eisenlohr 792e5045b8 fixed grid size assignments for MPI layers 2020-09-24 19:05:10 +02:00
Martin Diehl 79d672f4a7 cleaning 2020-09-24 17:04:06 +02:00
Martin Diehl f8816a6e0c Merge remote-tracking branch 'origin/development' into stress-ramp-loadcase 2020-09-24 16:57:07 +02:00
Martin Diehl 0f64954300 whitespace adjustment 2020-09-24 09:36:19 +02:00
Martin Diehl b995f34834 Merge branch 'development' into geom-fully-out-of-place 2020-09-23 22:50:20 +02:00
Martin Diehl fa413efcbb microstructure -> material 2020-09-23 21:25:14 +02:00
Martin Diehl cfeec53178 dataset is called 'material', not 'materialpoint'
avoid infinite loop in case it is not found
2020-09-23 21:10:39 +02:00
Martin Diehl 41fbc58c1b standard conforming name 2020-09-22 13:09:12 +02:00
Martin Diehl 53ce4e07d2 forgotten renames in subfolders 2020-09-22 13:02:33 +02:00
Martin Diehl 329cc1c953 tighter tolerance for stress 2020-09-20 17:36:11 +02:00
Martin Diehl 0a7d4f61ac Need only logical mask
'merge' substitutes multiplication with float mask
2020-09-20 16:54:58 +02:00
Martin Diehl 6367cb8fcb consistent handling of boundary conditions
A stress boundary condition 'P' indicates the stress at the end of the
load case (same as for 'F') 'Pdot' for given increase of (technical)
strain is not implemented.
Does not change anything for the most common case of zero-stress
boundary conditions, but simplifies the specification of stress ramps
2020-09-20 15:48:41 +02:00
Martin Diehl d584207e0a same layout for easy diff 2020-09-20 13:01:56 +02:00
Martin Diehl 8dfb972ac1 private is already default (module wide) 2020-09-20 11:49:20 +02:00
Martin Diehl 593a40b392 Merge branch 'Fortran-simplifications' into stress-ramp-loadcase 2020-09-20 11:42:04 +02:00
Martin Diehl 053c3f39ea solution completely relies on state defined by 'forward' 2020-09-19 23:40:17 +02:00
Martin Diehl d0b5905544 remaining write(6,...) without advance='no' 2020-09-19 11:02:40 +02:00
Martin Diehl c6c34ccf7e Merge remote-tracking branch 'origin/development' into stress-ramp-loadcase 2020-09-19 08:46:38 +02:00
Martin Diehl cc92b0ad84 print is more appropriate than write 2020-09-19 08:29:50 +02:00
Martin Diehl 1ff098d004 Merge remote-tracking branch 'origin/development' into Fortran-simplifications 2020-09-15 19:36:59 +02:00
Martin Diehl a2e9420336 boundary conditions to not change during iteration 2020-09-14 14:58:44 +02:00
Martin Diehl 89f25eb7d7 use reasonable tolerances for checking regular grid spacing 2020-09-14 14:06:09 +02:00
Martin Diehl 3ebba9b3c0 more sensible locations for reporting 2020-09-13 21:21:55 +02:00
Martin Diehl 5558d95886 print is better suited for output to screen then write 2020-09-13 21:15:08 +02:00
Martin Diehl 84b9104302 clearly indicate origin of functions
also supresses (flawed) error message of gfortran related to
non-standard type 'bytes'
2020-09-13 20:14:34 +02:00
Martin Diehl f266def906 Merge branch 'vtr-as-input' into Fortran-simplifications 2020-09-13 19:34:48 +02:00
Philip Eisenlohr 507910ffcd improved language/descriptions 2020-09-13 18:32:49 +02:00
Martin Diehl c14241a8e9 no need to store variables that are used only during init 2020-09-13 12:31:01 +02:00
Martin Diehl 316c5f7d20 internal errors (do not depend on user input) 2020-09-13 12:20:44 +02:00
Martin Diehl 3c5b89ac78 not needed anymore 2020-09-13 11:28:48 +02:00
Martin Diehl 74b35f5612 short numpy name 2020-09-13 11:18:57 +02:00
Martin Diehl 38a4118dc5 prefix to global variables increases readability 2020-09-13 11:05:42 +02:00
Martin Diehl b499578a95 prefix should be name of the module
poor substitute for namespace
2020-09-13 10:39:17 +02:00
Martin Diehl da0e16520c handling of MPI in 'parallelization' 2020-09-13 10:26:33 +02:00
Martin Diehl e2ded43636 polishing
- unified style (CamelCase)
- more sanity checks
- simplified determination of grid
2020-09-13 06:58:34 +02:00
Martin Diehl 81063046c4 improved error handling, potentially faster algorithm 2020-09-12 22:55:30 +02:00
Martin Diehl 307b1b20cc forgotten rename for ifort workaround 2020-09-12 15:26:16 +02:00
Martin Diehl 566ab7e7d9 reading in VTR files
will replace geom file in the near future
2020-09-12 14:43:04 +02:00
Martin Diehl 23bf51cca0 homogenizationAt from discretization not needed anymore 2020-08-29 16:45:18 +02:00
Sharan Roongta 7754a1ea56 Restructuring for material.yaml 2020-08-15 16:08:46 +02:00
Martin Diehl 68bf21c900 can use string of dynamic length 2020-08-09 06:40:43 +02:00
Martin Diehl 2db8ba13fc better reporting: show small values 2020-08-08 20:01:32 +02:00
Martin Diehl 8de3b67c26 no silent crash 2020-07-13 21:13:53 +02:00
Sharan Roongta 48b42debe0 redundant 2020-07-03 20:55:05 +02:00
Martin Diehl 432609ec14 cleaning 2020-07-03 16:45:11 +02:00
Sharan Roongta 2056b4223a better name 2020-07-01 23:01:37 +02:00
Sharan Roongta 02ee64bce4 make use of submodule property 2020-07-01 22:51:21 +02:00
Sharan Roongta dda2f2cf22 defined locally 2020-07-01 22:39:44 +02:00
Sharan Roongta 57e4d01a6b Merge branch 'development' into YAML-compatible-debug 2020-07-01 13:40:56 +02:00
Sharan Roongta 0b2d62e98d polishing 2020-06-29 17:05:11 +02:00
Martin Diehl 640bc7b190 [skip ci] polishing 2020-06-29 15:09:13 +02:00
Sharan Roongta 14a4dc5184 Merge branch 'YAML-compatible-numerics' into YAML-compatible-debug 2020-06-27 21:48:59 +02:00
Sharan Roongta 77e7e3d3c4 polishing 2020-06-26 20:12:05 +02:00
Sharan Roongta 78b6b3ecdb Merge branch 'development' into YAML-compatible-numerics 2020-06-25 11:02:54 +02:00
Sharan Roongta e155bef9a5 better names; polishing 2020-06-24 17:38:39 +02:00
Sharan Roongta 445d8b4f74 sanity checks 2020-06-24 17:09:15 +02:00
Sharan Roongta be84561e2e num structure replicated; polishing 2020-06-24 16:48:51 +02:00
Sharan Roongta 434bfffc46 hard coding of tolerance variables in solvers not correct 2020-06-24 16:39:09 +02:00
Sharan Roongta 6062cc43c4 extending num structure to other modules; hard coding of tol variables was incorrect 2020-06-24 16:37:30 +02:00
Sharan Roongta 692fc98fd5 'num' structure for data to avoid multiple reading of parameters 2020-06-24 16:35:47 +02:00
Martin Diehl e2a0e98267 small polishing 2020-06-23 11:06:41 +02:00
Sharan Roongta 7c4afe06c9 less generic variables 2020-06-19 03:56:16 +02:00
Sharan Roongta 0cf06a77d4 bugfix 2020-06-18 18:14:53 +02:00
Sharan Roongta 4942304ee8 extended for grid 2020-06-18 17:43:25 +02:00
Sharan Roongta cdb4a11a2e proper error message; Comments starting point is standardized 2020-06-18 00:17:43 +02:00
Sharan Roongta 0fc482585b used for both grid & mesh; polishing 2020-06-17 23:00:03 +02:00
Sharan Roongta ac2539b305 further cleaning of numerics.f90 2020-06-17 20:46:03 +02:00
Sharan Roongta d3f9e9f115 polishing 2020-06-17 18:02:22 +02:00
Sharan Roongta d4d29ff376 cleaning: comments added 2020-06-17 17:19:21 +02:00
Sharan Roongta f6355d199a better as local variables 2020-06-17 16:47:13 +02:00
Sharan Roongta e455dd4b9a sanity checks 2020-06-17 15:21:51 +02:00
Sharan Roongta 7f0c2d3825 further removal of public variables 2020-06-16 20:49:58 +02:00
Sharan Roongta 19c44d5e97 Read numerics.yaml once 2020-06-16 18:47:19 +02:00
Sharan Roongta c19ed21468 Begin to update DAMASK structure 2020-06-16 17:53:14 +02:00
Martin Diehl a9e0e93213 need to handle case of zero length file when splitting 2020-06-05 13:38:40 +02:00
Martin Diehl dc508cdfce Merge remote-tracking branch 'origin/misc-improvements' into vectorize_rotation 2020-05-15 23:25:42 +02:00
Martin Diehl 5a94218d23 fixes error:
[0]PETSC ERROR: Object is in wrong state
[0]PETSC ERROR: Cannot set coordinates until after DMDA has been setup
2020-05-11 08:02:34 +02:00
Martin Diehl 0f2447d413 restart does not overwrite existing results 2020-05-06 21:48:55 +02:00
Martin Diehl 7ec1ae977e new names
spectral => grid
FEM      => mesh

because there are FEM solvers for both discretizations. old names will
be available for a certain time
2020-04-25 09:56:51 +02:00
Martin Diehl 08ad9d1d57 was mixed up 2020-03-29 19:18:06 +02:00
Martin Diehl 7aa47d8f5a module name follows filename 2020-03-20 07:18:11 +01:00
Martin Diehl e1bd49a12b constants/parameters in capitals 2020-03-17 08:17:14 +01:00
Martin Diehl 0bb7fea782 sort into folders ...
and avoid names like mesh_mesh
2020-03-16 21:03:54 +01:00
Martin Diehl 5c4ddf5138 Merge branch 'development' into MiscImprovements 2020-03-14 12:52:30 +01:00
Martin Diehl 105853004a correct type conversions 2020-03-09 14:07:31 +01:00
Martin Diehl a1f36b14d3 simplifying
still trying to figure out how to best use HDF5 for reference stiffness
2020-03-09 14:05:49 +01:00
Martin Diehl 2bc36121b2 less public variables, clearer names 2020-02-29 12:57:19 +01:00
Martin Diehl 839443bc85 better (generic) name where possible 2020-02-26 07:06:25 +01:00
Martin Diehl 605e976915 I don't like loops
use language features and helper functions for shorter code
2020-02-23 09:45:19 +01:00
Martin Diehl 9e131c0110 rank 0 takes care of statistics file 2020-02-03 23:09:46 +01:00
Martin Diehl 269d65005b use nomenclature from the DAMASK paper 2020-01-31 00:07:23 +01:00
Martin Diehl 3b8dd17e5b avoiding hard-coded constants 2020-01-26 12:25:45 +01:00
Martin Diehl 9c7f6811a2 use default string length 2020-01-26 12:17:59 +01:00
Martin Diehl 1857a5e58a skip empty lines (i.e. blank line at the end) 2020-01-21 11:45:11 +01:00
Martin Diehl a18057ba4d use central functionality for file IO 2020-01-21 07:37:04 +01:00
Martin Diehl 5bc1c98da7 use 0-based indexing for worldrank 2020-01-12 00:49:03 +01:00
Martin Diehl bd6f2a6b5c consistent string length 2020-01-04 19:01:36 +01:00
Martin Diehl bd5f963260 polishing 2020-01-04 16:54:07 +01:00
Martin Diehl 326e3d0824 polishing 2020-01-03 14:02:14 +01:00
Martin Diehl 886e111064 not needed 2020-01-03 13:53:23 +01:00
Martin Diehl 2975e46ca1 not needed 2020-01-03 13:52:06 +01:00
Martin Diehl 34af10fac1 using default string length 2019-12-21 12:39:54 +01:00
Martin Diehl f0d3b29b82 Merge branch 'development' into MiscImprovements 2019-12-21 06:53:56 +01:00
Martin Diehl ee56b82c8a avoid spaces 2019-12-12 23:22:37 +01:00
Martin Diehl a0a99c526b some remaining IntOut format strings 2019-12-11 19:28:31 +01:00
Martin Diehl 9e801928b0 Merge branch 'development' into noPostResults 2019-12-11 09:28:45 +01:00
Martin Diehl 9b67ead62f removed postResults completely 2019-12-11 00:10:02 +01:00
Martin Diehl b0ce324213 Merge remote-tracking branch 'origin/development' into simple-int-formatting 2019-12-08 20:24:05 +01:00
Martin Diehl 4eacc1d16d polishing 2019-12-07 15:45:37 +01:00
Martin Diehl 7ecb0245ec simplified (use novel i0 format specifier) 2019-12-07 11:12:46 +01:00
Martin Diehl f5292019e5 use rotation class 2019-12-02 20:23:50 +01:00
Martin Diehl 8a9d3f8d6d avoid code duplication 2019-12-02 20:09:27 +01:00
Martin Diehl 83453d10ef use rotation class for consistent handling of rotations 2019-12-02 16:37:22 +01:00
Martin Diehl a6a6519678 more local data handling 2019-11-24 07:44:17 +01:00
Martin Diehl 368d4debda calculate average nodal position directly
no need to average and have second memory access
2019-10-30 14:49:08 +01:00
Martin Diehl 40507846c9 cell displacement are between nodes which start at (0,0,0) 2019-10-30 14:47:42 +01:00
Martin Diehl 1d2d7d1ea3 remove public variables
they make code unreadable and unmaintainable
2019-10-29 23:24:12 +01:00
Martin Diehl 0c6b7e1112 not nice, but working ... 2019-10-29 23:15:02 +01:00
Martin Diehl 402e681cf5 initialization of arrays for fourier transform more reasonable
- padding entries in real data array need to be zero
- all values of the fourier data arrays are explicitly set
2019-10-29 16:18:58 +01:00
Martin Diehl 1ae33cf215 avoid one loop and use filtered frequencies 2019-10-29 09:15:35 +01:00
Martin Diehl f451d19c1e forall is obsolete
some calculation simplified
2019-10-28 21:27:57 +01:00
Martin Diehl c47f516769 do not correct fluctuations 2019-10-28 21:16:43 +01:00
Martin Diehl d1f719d3cf separation of "age" and "forward" not useful 2019-10-28 13:36:36 +01:00
Martin Diehl 8de6fcfc24 unifying names 2019-10-28 13:29:32 +01:00
Martin Diehl ab4a98fb53 make use of HDF5 and structure data 2019-10-28 13:17:05 +01:00
Martin Diehl 10f2c53256 clearly distiguish
- DAMASK as a materialpoint model (CPFEM, not fitting name)
- solver
2019-10-25 08:30:12 +02:00
Martin Diehl 07d8379313 further untangling 2019-10-25 07:55:23 +02:00
Martin Diehl cf8b16c066 better have one function per task
but separating ageing and forward for the solver is not trivial due to
guessing
2019-10-25 07:31:09 +02:00
Martin Diehl eb4cad17b5 avoid public variables 2019-10-25 00:53:48 +02:00
Martin Diehl 378729f5c4 clearer structure 2019-10-25 00:42:59 +02:00
Martin Diehl 9db5cbb667 trying to get rid of a global "restartWrite" variable 2019-10-24 22:50:30 +02:00
Martin Diehl 0bc4326618 better have one function per task 2019-10-24 13:46:36 +02:00
Martin Diehl 71def397d5 no need to age before writing restart data 2019-10-24 13:14:40 +02:00
Martin Diehl 176f6028cd CPFE2 writes current variables (like grid solvers) 2019-10-24 13:06:42 +02:00
Martin Diehl c0c0831c92 multiple keyword are more confusing then helpful 2019-10-24 06:37:28 +02:00
Martin Diehl 50769b52a5 don't continue if calculation did not converge 2019-10-24 06:32:46 +02:00
Martin Diehl 0483fc7b3f small functions with one task are better 2019-10-24 06:16:42 +02:00
Martin Diehl 534073358e arguments are better than public variables 2019-10-23 23:06:47 +02:00
Martin Diehl 67228b46a6 modularize 2019-10-23 22:50:01 +02:00
Martin Diehl 52190382ac cleaning 2019-10-23 22:42:46 +02:00
Martin Diehl ad75ebd973 polishing 2019-09-29 11:26:57 -07:00
Martin Diehl 56c0f30687 tried to send to much data 2019-09-29 10:34:55 -07:00
Martin Diehl 8e5fd7c5e8 nodal discplacements for MPI
needs improvement with respect to readability and placement of origin
2019-09-29 10:04:07 -07:00
Martin Diehl e04b074f3c easier to read 2019-09-28 18:32:17 -07:00
Martin Diehl 3206ee04bc nodal displacements for grid solver
currently for non-MPI only
2019-09-27 20:38:02 -07:00
Martin Diehl 5ba6b6c244 name reflects planned functionality:
should update node and cell center coordinates
2019-09-27 15:02:36 -07:00
Martin Diehl e311c913b8 avoid public variable without write protection 2019-09-27 14:44:28 -07:00
Martin Diehl 13c62b890b module name should reflect file name 2019-09-27 14:34:34 -07:00
Martin Diehl 96811f77ca not used 2019-09-23 06:50:25 -07:00
Martin Diehl c0210659b6 statUnit was not opened, stat file was written to STDERR 2019-09-22 15:56:37 -07:00
Martin Diehl 26bdcd64b9 this might resolve the occasional MPI restart test failuers 2019-09-22 15:34:05 -07:00
Martin Diehl 53283d5c01 using newer interface 2019-09-20 18:20:33 -07:00
Martin Diehl ad83c8541d same names as in python 2019-09-20 17:18:09 -07:00
Martin Diehl 7e6265b128 make use of consistency checks 2019-09-20 16:52:55 -07:00
Martin Diehl 23dba41a09 absolutely not needed
the solvers report when they are initialized
2019-09-20 05:41:12 -07:00
Eureka Pai Kulyadi ca760f9ca1 added text lines 2019-09-06 15:47:02 -04:00
Martin Diehl 619c67cc19 fixed array access 2019-06-30 01:29:36 +02:00
Martin Diehl 7ad343c9b6 polishing 2019-06-29 15:06:47 -07:00
Martin Diehl 4b10522bee catch user inputs that result in division by zero 2019-06-28 17:52:38 -07:00
Martin Diehl a88baf93b2 avoid division (mod) by zero 2019-06-28 17:09:27 -07:00
Martin Diehl 25d02c2f19 most of the functionality is only relevant for commercial FEM 2019-06-15 16:21:04 +02:00
Martin Diehl 9dfe71aa06 better readable 2019-06-10 09:42:23 +02:00
Martin Diehl cfc1dcf04b mesh_elem and theMesh are deprecated 2019-06-06 22:49:17 +02:00
Martin Diehl 14da4f8e43 easier to store positions than displacement 2019-06-06 18:28:10 +02:00
Martin Diehl d4392dc1bd one implicit none is enough 2019-05-30 23:58:59 +02:00
Martin Diehl 305c72584f Merge branch 'development' into test_PETSc_pointer 2019-05-30 17:31:51 +02:00
Martin Diehl 51e19048f7 pInt not needed anymore 2019-05-14 22:52:33 +02:00
Martin Diehl 7d5f5afe01 further cleaning 2019-05-12 13:11:30 +02:00
Martin Diehl d5f80c7f6d Merge branch 'development' into MiscImprovements 2019-05-04 18:16:09 +02:00
Martin Diehl ebf01dee4f store grid/size at geometry group
as outlined in the DAMASK results paper
2019-05-03 06:46:22 +02:00
Martin Diehl 5a0e408d59 Merge branch 'development' into SolverRestart-in-HDF5 2019-04-30 17:07:45 +02:00
Martin Diehl b8bf329a74 Merge branch 'development' into MiscImprovements 2019-04-30 00:02:35 +02:00
Martin Diehl 477478f66c source code structure reflects build targets 2019-04-29 10:43:49 +02:00