{"action":"created","comment":{"url":"https://api.github.com/repos/lammps/lammps/pulls/comments/212105053","pull_request_review_id":148667682,"id":212105053,"node_id":"MDI0OlB1bGxSZXF1ZXN0UmV2aWV3Q29tbWVudDIxMjEwNTA1Mw==","diff_hunk":"@@ -139,6 +139,34 @@ set(LAMMPS_LINK_LIBS)\n set(LAMMPS_DEPS)\n set(LAMMPS_API_DEFINES)\n \n+set(DEFAULT_PACKAGES ASPHERE BODY CLASS2 COLLOID COMPRESS DIPOLE GRANULAR\n+  KSPACE MANYBODY MC MEAM MISC MOLECULE PERI REAX REPLICA RIGID SHOCK SPIN SNAP\n+  SRD KIM PYTHON MSCG MPIIO VORONOI POEMS LATTE USER-ATC USER-AWPMD USER-BOCS\n+  USER-CGDNA USER-MESO USER-CGSDK USER-COLVARS USER-DIFFRACTION USER-DPD USER-DRUDE\n+  USER-EFF USER-FEP USER-H5MD USER-LB USER-MANIFOLD USER-MEAMC USER-MGPT USER-MISC\n+  USER-MOFFF USER-MOLFILE USER-NETCDF USER-PHONON USER-QTB USER-REAXC USER-SCAFACOS \n+  USER-SMD USER-SMTBQ USER-SPH USER-TALLY USER-UEF USER-VTK USER-QUIP USER-QMMM)\n+set(ACCEL_PACKAGES USER-OMP KOKKOS OPT USER-INTEL GPU)\n+set(OTHER_PACKAGES CORESHELL QEQ)\n+foreach(PKG ${DEFAULT_PACKAGES})\n+  option(PKG_${PKG} \"Build ${PKG} Package\" OFF)\n+endforeach()\n+foreach(PKG ${ACCEL_PACKAGES} ${OTHER_PACKAGES})\n+  option(PKG_${PKG} \"Build ${PKG} Package\" OFF)\n+endforeach()\n+\n+######################################################\n+# packages with special compiler needs or external libs\n+######################################################\n+if(PKG_REAX OR PKG_MEAM OR PKG_USER-QUIP OR PKG_USER-QMMM OR PKG_LATTE OR PKG_USER-SCAFACOS)\n+  enable_language(Fortran)\n+endif()\n+\n+if(PKG_MEAM OR PKG_USER-H5MD OR PKG_USER-QMMM OR PKG_USER-SCAFACOS)\n+  enable_language(C)\n+endif()\n+\n+# do MPI detection after language activation, if MPI for these language is required","path":"cmake/CMakeLists.txt","position":31,"original_position":31,"commit_id":"fd56124a94288635c942ac33a8c4aacd60231d74","original_commit_id":"fd56124a94288635c942ac33a8c4aacd60231d74","user":{"login":"junghans","id":439483,"node_id":"MDQ6VXNlcjQzOTQ4Mw==","avatar_url":"https://avatars1.githubusercontent.com/u/439483?v=4","gravatar_id":"","url":"https://api.github.com/users/junghans","html_url":"https://github.com/junghans","followers_url":"https://api.github.com/users/junghans/followers","following_url":"https://api.github.com/users/junghans/following{/other_user}","gists_url":"https://api.github.com/users/junghans/gists{/gist_id}","starred_url":"https://api.github.com/users/junghans/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/junghans/subscriptions","organizations_url":"https://api.github.com/users/junghans/orgs","repos_url":"https://api.github.com/users/junghans/repos","events_url":"https://api.github.com/users/junghans/events{/privacy}","received_events_url":"https://api.github.com/users/junghans/received_events","type":"User","site_admin":false},"body":"This is the reason why the block had to be moved up.","created_at":"2018-08-22T20:55:47Z","updated_at":"2018-08-22T20:55:47Z","html_url":"https://github.com/lammps/lammps/pull/989#discussion_r212105053","pull_request_url":"https://api.github.com/repos/lammps/lammps/pulls/989","author_association":"MEMBER","_links":{"self":{"href":"https://api.github.com/repos/lammps/lammps/pulls/comments/212105053"},"html":{"href":"https://github.com/lammps/lammps/pull/989#discussion_r212105053"},"pull_request":{"href":"https://api.github.com/repos/lammps/lammps/pulls/989"}}},"pull_request":{"url":"https://api.github.com/repos/lammps/lammps/pulls/989","id":200213074,"node_id":"MDExOlB1bGxSZXF1ZXN0MjAwMjEzMDc0","html_url":"https://github.com/lammps/lammps/pull/989","diff_url":"https://github.com/lammps/lammps/pull/989.diff","patch_url":"https://github.com/lammps/lammps/pull/989.patch","issue_url":"https://api.github.com/repos/lammps/lammps/issues/989","number":989,"state":"open","locked":false,"title":"[Feature Contribution] Scafacos","user":{"login":"rhalver","id":20355826,"node_id":"MDQ6VXNlcjIwMzU1ODI2","avatar_url":"https://avatars3.githubusercontent.com/u/20355826?v=4","gravatar_id":"","url":"https://api.github.com/users/rhalver","html_url":"https://github.com/rhalver","followers_url":"https://api.github.com/users/rhalver/followers","following_url":"https://api.github.com/users/rhalver/following{/other_user}","gists_url":"https://api.github.com/users/rhalver/gists{/gist_id}","starred_url":"https://api.github.com/users/rhalver/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/rhalver/subscriptions","organizations_url":"https://api.github.com/users/rhalver/orgs","repos_url":"https://api.github.com/users/rhalver/repos","events_url":"https://api.github.com/users/rhalver/events{/privacy}","received_events_url":"https://api.github.com/users/rhalver/received_events","type":"User","site_admin":false},"body":"## Purpose\r\n\r\nFix for the ScaFaCoS library[1], a library for the computation of electro-statics, providing several solvers to choose from, e.g. FMM or P3M. The library was developed in a project funded by the\r\nGerman Ministry of Science and Education from 2009-2012.\r\n\r\n## Author(s)\r\n\r\nRene Halver, Juelich Supercomputing Centre, Forschungszentrum Juelich, Germany\r\n\r\n## Backward Compatibility\r\n\r\nNo changes in backward compatibility are expected.\r\n\r\n## Implementation Notes\r\n\r\nNo other features are influenced by this fix. Within the fix the Coulomb field and potentials\r\nare computed and resulting from them the forces and energy are calculated.Some\r\nchanges might be required to completely adhere to the LAMMPS environment.\r\n\r\n## Post Submission Checklist\r\n\r\n_Please check the fields below as they are completed_\r\n- [x] The feature or features in this pull request is complete\r\n- [x] Suitable new documentation files and/or updates to the existing docs are included\r\n- [X] One or more example input decks are included\r\n- [X] The source code follows the LAMMPS formatting guidelines\r\n\r\n## Further Information, Files, and Links\r\n\r\n[1] www.scafacos.de\r\n\r\n","created_at":"2018-07-09T20:37:54Z","updated_at":"2018-08-22T20:55:47Z","closed_at":null,"merged_at":null,"merge_commit_sha":"515483a55583552bb54005b1f10204789f037e04","assignee":{"login":"akohlmey","id":289251,"node_id":"MDQ6VXNlcjI4OTI1MQ==","avatar_url":"https://avatars3.githubusercontent.com/u/289251?v=4","gravatar_id":"","url":"https://api.github.com/users/akohlmey","html_url":"https://github.com/akohlmey","followers_url":"https://api.github.com/users/akohlmey/followers","following_url":"https://api.github.com/users/akohlmey/following{/other_user}","gists_url":"https://api.github.com/users/akohlmey/gists{/gist_id}","starred_url":"https://api.github.com/users/akohlmey/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/akohlmey/subscriptions","organizations_url":"https://api.github.com/users/akohlmey/orgs","repos_url":"https://api.github.com/users/akohlmey/repos","events_url":"https://api.github.com/users/akohlmey/events{/privacy}","received_events_url":"https://api.github.com/users/akohlmey/received_events","type":"User","site_admin":false},"assignees":[{"login":"akohlmey","id":289251,"node_id":"MDQ6VXNlcjI4OTI1MQ==","avatar_url":"https://avatars3.githubusercontent.com/u/289251?v=4","gravatar_id":"","url":"https://api.github.com/users/akohlmey","html_url":"https://github.com/akohlmey","followers_url":"https://api.github.com/users/akohlmey/followers","following_url":"https://api.github.com/users/akohlmey/following{/other_user}","gists_url":"https://api.github.com/users/akohlmey/gists{/gist_id}","starred_url":"https://api.github.com/users/akohlmey/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/akohlmey/subscriptions","organizations_url":"https://api.github.com/users/akohlmey/orgs","repos_url":"https://api.github.com/users/akohlmey/repos","events_url":"https://api.github.com/users/akohlmey/events{/privacy}","received_events_url":"https://api.github.com/users/akohlmey/received_events","type":"User","site_admin":false},{"login":"junghans","id":439483,"node_id":"MDQ6VXNlcjQzOTQ4Mw==","avatar_url":"https://avatars1.githubusercontent.com/u/439483?v=4","gravatar_id":"","url":"https://api.github.com/users/junghans","html_url":"https://github.com/junghans","followers_url":"https://api.github.com/users/junghans/followers","following_url":"https://api.github.com/users/junghans/following{/other_user}","gists_url":"https://api.github.com/users/junghans/gists{/gist_id}","starred_url":"https://api.github.com/users/junghans/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/junghans/subscriptions","organizations_url":"https://api.github.com/users/junghans/orgs","repos_url":"https://api.github.com/users/junghans/repos","events_url":"https://api.github.com/users/junghans/events{/privacy}","received_events_url":"https://api.github.com/users/junghans/received_events","type":"User","site_admin":false},{"login":"rbberger","id":2828630,"node_id":"MDQ6VXNlcjI4Mjg2MzA=","avatar_url":"https://avatars1.githubusercontent.com/u/2828630?v=4","gravatar_id":"","url":"https://api.github.com/users/rbberger","html_url":"https://github.com/rbberger","followers_url":"https://api.github.com/users/rbberger/followers","following_url":"https://api.github.com/users/rbberger/following{/other_user}","gists_url":"https://api.github.com/users/rbberger/gists{/gist_id}","starred_url":"https://api.github.com/users/rbberger/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/rbberger/subscriptions","organizations_url":"https://api.github.com/users/rbberger/orgs","repos_url":"https://api.github.com/users/rbberger/repos","events_url":"https://api.github.com/users/rbberger/events{/privacy}","received_events_url":"https://api.github.com/users/rbberger/received_events","type":"User","site_admin":false}],"requested_reviewers":[{"login":"rbberger","id":2828630,"node_id":"MDQ6VXNlcjI4Mjg2MzA=","avatar_url":"https://avatars1.githubusercontent.com/u/2828630?v=4","gravatar_id":"","url":"https://api.github.com/users/rbberger","html_url":"https://github.com/rbberger","followers_url":"https://api.github.com/users/rbberger/followers","following_url":"https://api.github.com/users/rbberger/following{/other_user}","gists_url":"https://api.github.com/users/rbberger/gists{/gist_id}","starred_url":"https://api.github.com/users/rbberger/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/rbberger/subscriptions","organizations_url":"https://api.github.com/users/rbberger/orgs","repos_url":"https://api.github.com/users/rbberger/repos","events_url":"https://api.github.com/users/rbberger/events{/privacy}","received_events_url":"https://api.github.com/users/rbberger/received_events","type":"User","site_admin":false},{"login":"sjplimp","id":21087682,"node_id":"MDQ6VXNlcjIxMDg3Njgy","avatar_url":"https://avatars1.githubusercontent.com/u/21087682?v=4","gravatar_id":"","url":"https://api.github.com/users/sjplimp","html_url":"https://github.com/sj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