Alex Selimov
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73fca4a0d8
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Added efill zigzag code which adjusts the efill option
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4 years ago |
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Alex Selimov
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8d939ed942
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Merge bcc to development branch
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5 years ago |
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Alex Selimov
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a47c384a3f
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Added tags to the element and atom arrays
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5 years ago |
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Alex Selimov
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43025d0b67
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Quick fix to efill code
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5 years ago |
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Alex Selimov
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aef9da49be
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Added greater range of element sizes
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5 years ago |
|
Alex Selimov
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5dda0e3b81
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Added efill option
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5 years ago |
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Alex Selimov
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8693d7aaa9
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Initial testing of efill code
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5 years ago |
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Alex Selimov
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32ab5a6058
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Added basic basis functionality to code
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5 years ago |
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Alex Selimov
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ffbe83f2f5
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Added ability to have spaces in orient string if passed with quotes
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5 years ago |
|
Alex Selimov
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acd902db4b
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working changes to bcc files
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5 years ago |
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Alex Selimov
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de1d230b87
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Remove sub_box_arrary_bd as it isn't needed
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5 years ago |
Alex
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20755270a4
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Debugging version of code
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5 years ago |
|
Alex
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d0b6c595f0
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Fix to outputting single element
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5 years ago |
|
Alex Selimov
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1b82d98a4f
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Added right hand rule check to orientation in mode_create
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5 years ago |
|
Alex Selimov
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98d00ea431
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Fix problems with mode_create.f90
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5 years ago |
|
Alex Selimov
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b97986bf04
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change box definition
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5 years ago |
|
Alex Selimov
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44efb4be4a
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Added orient and unorient options
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5 years ago |
|
Alex
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dc42b7b925
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Separated wrap option to reduce opy and pasted code. Fixed warnings and added wrapping when inserting a dislocation or loop
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5 years ago |
|
Alex Selimov
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9ebdfff0a1
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Added print messages to let user know whats going on
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5 years ago |
|
Alex Selimov
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849da1d24a
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Changes to how the adjustment to nodal positions is performed for lammpscac output
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5 years ago |
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Alex Selimov
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c89b7d3b59
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Merge branch 'ft--opt-dislloop' into development
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5 years ago |
|
Alex Selimov
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fbae3a1594
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Working version of CACmb capable of building simple models for lammpsCAC
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5 years ago |
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Alex Selimov
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d09ebfa7e0
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Merge branch 'development' into ft-write-lammpscac
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5 years ago |
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Alex Selimov
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ba28734fd7
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Working changes to write lammps cac
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5 years ago |
|
Alex
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d0e6253d64
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Working commit for dislocation generation branch
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5 years ago |
|
Alex Selimov
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41024b9674
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Added new parse ori_vec subroutine to parse orientation vectors
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5 years ago |
|
Alex Selimov
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0dff3b2ca9
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Restructure the command parsing loops so the mode commands only parse the mode options
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5 years ago |
|
Alex Selimov
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b0941e4482
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Fixes to file reading to ensure that mode_merge works correctly
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5 years ago |
|
Alex
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fb2abc60d1
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Updates to box variables adding new sub_box variables and propagating changes through all of the modes
|
5 years ago |
|
Alex Selimov
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03f69c6df7
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Removed extra variables from mode_create.f90, added a new module to contain simulation box information and changed code accordingly, new grow subroutine in elements.
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5 years ago |
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Alex Selimov
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fa1cb6ce58
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Fixes to mode_create, moved basis_pos from elements to mode_create, added the mb file output style
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5 years ago |
|
Alex Selimov
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591762d259
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Latest attempts to get the lammpscac data format working
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5 years ago |
|
Alex Selimov
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c1150ae4b1
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First attempts at figuring out the element format for lammpscac
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5 years ago |
|
Alex Selimov
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54aa50b605
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Working writing to lammpsCAC format
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5 years ago |
|
Alex
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ff3fc5e20a
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First working version of model builder with several output file types and mode_create working
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5 years ago |
|
Alex
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8217e8b51c
|
Initial commit with file writing and create mode working for atoms
|
5 years ago |
