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ORNL-CEES
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thermochimica
Computational library for chemical thermodynamics and phase equilibrium calculation. Multiphysics and standalone estimations of chemical state and constitutive and transport properties.
BSD 3-Clause "New" or "Revised" License
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Change the actions to use Civet
#162
parikshitbajpai
closed
1 month ago
0
Parallel build does not work reliably
#161
parikshitbajpai
closed
1 month ago
0
Fix parallel build
#160
parikshitbajpai
closed
1 month ago
1
Naming convention, adding data from website, and CsI test
#159
aidanfitz
closed
3 months ago
1
Update YAML for bug report
#158
parikshitbajpai
closed
4 months ago
0
YAML based issue templates
#157
parikshitbajpai
closed
4 months ago
0
Constraint system for phase field
#156
parikshitbajpai
opened
4 months ago
0
bash input script update
#155
aidanfitz
closed
4 months ago
1
Update README.md
#154
parikshitbajpai
closed
5 months ago
0
Remove 132 character restriction on line length
#153
parikshitbajpai
closed
5 months ago
0
Pseudo Binary Phase Diagram: Incompatible Dimensions for Cross Product
#152
mlouis9
closed
6 months ago
1
GEM iteration in reinit data
#151
parikshitbajpai
closed
8 months ago
0
Rename `ReinitData` to `ReinitializationData` for style consistency.
#150
parikshitbajpai
closed
9 months ago
1
Fix wrong conditionals in leveling solver
#149
parikshitbajpai
closed
10 months ago
0
Invalid memory writes
#148
parikshitbajpai
closed
10 months ago
0
New data for YH
#147
tophmatthews
closed
11 months ago
5
Improve reallocation in reinit data
#146
parikshitbajpai
closed
1 year ago
0
Possible Issue with precision on inclusion of elements in system
#145
mtnwalker
opened
1 year ago
0
Add missing include
#144
parikshitbajpai
closed
1 year ago
0
Dynamic memory allocation in Levelling
#143
parikshitbajpai
closed
1 year ago
0
MQMQA phase check and levelling allocation fix
#142
parikshitbajpai
closed
1 year ago
1
MQMQA pair outputs for API
#141
parikshitbajpai
closed
1 year ago
2
Adjust tolerances
#140
parikshitbajpai
opened
1 year ago
0
Reduce dynamic memory allocations
#139
parikshitbajpai
opened
1 year ago
2
API utility functions for MOOSE integration
#138
parikshitbajpai
closed
1 year ago
1
Utility functions for Thermochimica API
#137
parikshitbajpai
closed
1 year ago
0
Add FFPE_TRAPS flag in Makefile
#136
parikshitbajpai
closed
1 year ago
0
Memory access error on Xeon W
#135
parikshitbajpai
closed
1 year ago
0
Increase supported filepath length
#134
parikshitbajpai
closed
1 year ago
0
Changing Subroutine name for BlueCrab Integration #132
#133
mtnwalker
closed
1 year ago
2
Blue_crab Integration
#132
mtnwalker
closed
1 year ago
1
Increase supported file path length
#131
dschwen
closed
1 year ago
0
User-specified minimum species per phase overridden when system has 2 or fewer elements
#130
maxposchmann
opened
1 year ago
0
Fix missing presetElementMass function
#129
parikshitbajpai
closed
1 year ago
0
presetElementMass is missing from Thermochimica-cxx.[C,h]
#128
maxposchmann
closed
1 year ago
0
Update phaseDiagramGUI doco
#127
parikshitbajpai
closed
1 year ago
0
Flat Miscibility Gap Tops
#126
maxposchmann
opened
1 year ago
0
MQMQA reciprocal excess mixing
#125
maxposchmann
opened
1 year ago
2
Change default in CompMolFraction: phase models don't need to be listed
#124
maxposchmann
closed
1 year ago
0
Remove unused variables
#123
dschwen
closed
1 year ago
1
Don't let SubMinLineSearch try to push species concentrations above 1
#122
maxposchmann
closed
1 year ago
0
Quick fix for factor of 2 in reciprocal terms
#121
maxposchmann
closed
1 year ago
0
Take absolute values of charges when parsing
#120
maxposchmann
closed
1 year ago
0
Revert GEMLineSearch to use dElementPotentialLast
#119
maxposchmann
closed
1 year ago
0
Plot upgrades
#118
maxposchmann
closed
1 year ago
0
Fuzzy (randomized) stoichiometry
#117
maxposchmann
closed
1 year ago
1
Add GUI docs
#116
maxposchmann
closed
1 year ago
0
Update fuzzy
#115
maxposchmann
closed
1 year ago
0
Fix label remove bug
#114
maxposchmann
closed
1 year ago
0
Python common
#113
maxposchmann
closed
1 year ago
0
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