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  1. Jul 31, 2018
  2. Jul 30, 2018
    • HaoZeke's avatar
      emacs: Major readme update and refactor · a00d7bec
      HaoZeke authored
      Also update the license and switch to GPL v2 like lammps
      a00d7bec
    • HaoZeke's avatar
      emacs: Stop forcing filename patterns · 2c9e96be
      HaoZeke authored
      2c9e96be
    • HaoZeke's avatar
      emacs: Update mode file · 82fc3b99
      HaoZeke authored
      This is a squashed commit including the following changes:
      1) Update mode header
      2) Clean up white-space
      3) Fix free variable warning
      4) Add proper file ending stuff
      5) Rename to keep conventional naming scheme
      6) Updates to the readme
      7) Update to conform to `package-lint` criteria
      8) Add license header
      9) Add in-file instructions
      82fc3b99
  3. Jun 28, 2018
  4. Mar 12, 2018
  5. Feb 19, 2018
  6. Feb 16, 2018
    • Evangelos Voyiatzis's avatar
      Update error.cpp · b220b647
      Evangelos Voyiatzis authored
      When compiling with g++ (GCC) 4.4.7 20120313 (Red Hat 4.4.7-18) an error occurs: 
      error.cpp: In member function ‘void Error::generate_error(unsigned int, std::string, std::string)’:
      error.cpp:146: error: ‘exit’ was not declared in this scope
      The fix is to include the #include <cstdlib> where the exit() function is decleared in the error.cpp file
      b220b647
  7. Jan 28, 2018
  8. Jan 17, 2018
  9. Jan 16, 2018
  10. Jan 15, 2018
    • Dr. Nandor Tamaskovics's avatar
      Tools for LAMMPS documentation with the "doxygen" documentation platform · 26d6f6d1
      Dr. Nandor Tamaskovics authored
      are provided.
      
              New directory: tools/doxygen
      
              New file:      tools/doxygen/Developer.dox.lammps
              New file:      tools/doxygen/Doxyfile.lammps
              New file:      tools/doxygen/doxygen.sh
              New file:      tools/doxygen/README
      
      The Developer.dox.lammps file contains a slightly revised version of the
      Developer.pdf file adopted to the LAMMPS "doxygen" documentation.
      
      The Doxyfile.lammps file is a first proposal for a LAMMPS "doxygen"
      documentation flavor and can be adjusted to specific requirements.
      
      The "doxygen.sh" shell script generates the LAMMPS "doxygen"
      documentation.
      
      Detailed instructions can be found in the README file.
      26d6f6d1
  11. Oct 26, 2017
  12. Sep 30, 2017
    • Axel Kohlmeyer's avatar
      cleanup/simplification of compilation for fix phonon analysis tool "phana" · 4c71beb0
      Axel Kohlmeyer authored
      - include the used tricubic functions directly as static functions
      - silence compiler warnings
      - define f2c.h imported data types directly or use C equivalents
      - since the direct LAPACK API was called and not cLAPACK, declare LAPACK interface and depend only on LAPACK
      - add proper dependencies
      - disable automatic minor version number generation. step version manually.
      - comment out optional spglib functionality by default
      4c71beb0
  13. Aug 31, 2017
  14. Aug 24, 2017
  15. Aug 23, 2017
  16. Aug 14, 2017
  17. Jul 11, 2017
  18. Apr 17, 2017
  19. Mar 21, 2017
  20. Mar 20, 2017
  21. Mar 07, 2017
  22. Mar 06, 2017
  23. Mar 05, 2017
  24. Feb 04, 2017
  25. Jan 11, 2017
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