Acknowledgements and citations

The CAC simulator and analyser were written in Fortran by Shuozhi Xu; the Python scripting interface was written by Alex Selimov and Kevin Chu; the code in its present form is a culmination of developments over the last decades.

The PyCAC code development was sponsored by

If you use PyCAC results in your published work, please cite these papers

as well as the website www.pycac.org, i.e.,

@article{xu_pycac_2018,
         title = {Py{CAC}: {The} concurrent atomistic-continuum simulation environment},
         volume = {33},
         issn = {0884-2914, 2044-5326},
         doi = {10.1557/jmr.2018.8},
         abstract = {We present a ...},
         journal = {J. Mater. Res.},
         author = {Xu, Shuozhi and Payne, Thomas G. and Chen, Hao and Liu, Yongchao and Xiong, Liming and Chen, Youping and McDowell, David L.},
         month = apr,
         year = {2018},
         pages = {857--871}}

@article{xu_quasistatic_2015,
         title = {A quasistatic implementation of the concurrent atomistic-continuum method for {FCC} crystals},
         volume = {72},
         issn = {0749-6419},
         doi = {10.1016/j.ijplas.2015.05.007},
         abstract = {In recent years, ...},
         journal = {Int. J. Plast.},
         author = {Xu, Shuozhi and Che, Rui and Xiong, Liming and Chen, Youping and McDowell, David L.},
         month = sep,
         year = {2015},
         pages = {91--126}}

@article{xiong_coarse-grained_2011,
          title = {Coarse-grained atomistic simulation of dislocations},
          volume = {59},
          issn = {0022-5096},
          doi = {10.1016/j.jmps.2010.11.005},
          abstract = {This paper presents ...},
          number = {2},
          journal = {J. Mech. Phys. Solids},
          author = {Xiong, Liming and Tucker, Garritt and McDowell, David L. and Chen, Youping},
          month = feb,
          year = {2011},
          pages = {160--177}}

@article{chen_reformulation_2009,
         title = {Reformulation of microscopic balance equations for multiscale materials modeling},
         volume = {130},
         issn = {00219606},
         doi = {10.1063/1.3103887},
         abstract = {In this paper ...},
         number = {13},
         journal = {J. Chem. Phys.},
         author = {Chen, Youping},
         month = apr,
         year = {2009},
         pages = {134706}}

@misc{xu_pycac-manual_2018,
      title = {Py{CAC} {User}'s {Manual}},
      howpublished = {\url{http://www.pycac.org/}},
      author = {Xu, Shuozhi},
      month = aug,
      year = {2017},
      note = {Accessed: \today}}

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