{"action":"created","comment":{"url":"https://api.github.com/repos/MRChemSoft/mrchem/pulls/comments/237826995","pull_request_review_id":180221933,"id":237826995,"node_id":"MDI0OlB1bGxSZXF1ZXN0UmV2aWV3Q29tbWVudDIzNzgyNjk5NQ==","diff_hunk":"@@ -641,6 +645,7 @@ void XCFunctional::calcPotentialLDA(FunctionTreeVector<3> &potentials) {\n  * and whether explicit or gamma-type derivatives have been used in xcfun.\n  */\n void XCFunctional::calcPotentialGGA(FunctionTreeVector<3> &potentials) {\n+    if(this->order > 1) MSG_FATAL(\"Not implemented: abort!\");","path":"src/mrdft/XCFunctional.cpp","position":33,"original_position":33,"commit_id":"d5e01bbc0e82125614ffd8ed53d33d9bb50efb9d","original_commit_id":"d5e01bbc0e82125614ffd8ed53d33d9bb50efb9d","user":{"login":"ilfreddy","id":3807782,"node_id":"MDQ6VXNlcjM4MDc3ODI=","avatar_url":"https://avatars0.githubusercontent.com/u/3807782?v=4","gravatar_id":"","url":"https://api.github.com/users/ilfreddy","html_url":"https://github.com/ilfreddy","followers_url":"https://api.github.com/users/ilfreddy/followers","following_url":"https://api.github.com/users/ilfreddy/following{/other_user}","gists_url":"https://api.github.com/users/ilfreddy/gists{/gist_id}","starred_url":"https://api.github.com/users/ilfreddy/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/ilfreddy/subscriptions","organizations_url":"https://api.github.com/users/ilfreddy/orgs","repos_url":"https://api.github.com/users/ilfreddy/repos","events_url":"https://api.github.com/users/ilfreddy/events{/privacy}","received_events_url":"https://api.github.com/users/ilfreddy/received_events","type":"User","site_admin":false},"body":"Fixed. But I noticed such functionality is inherited from MRCPP. Maybe we should have a separate messaging library used by both MRCPP and MRChem?","created_at":"2018-11-30T11:16:54Z","updated_at":"2018-11-30T11:16:54Z","html_url":"https://github.com/MRChemSoft/mrchem/pull/161#discussion_r237826995","pull_request_url":"https://api.github.com/repos/MRChemSoft/mrchem/pulls/161","author_association":"CONTRIBUTOR","_links":{"self":{"href":"https://api.github.com/repos/MRChemSoft/mrchem/pulls/comments/237826995"},"html":{"href":"https://github.com/MRChemSoft/mrchem/pull/161#discussion_r237826995"},"pull_request":{"href":"https://api.github.com/repos/MRChemSoft/mrchem/pulls/161"}},"in_reply_to_id":237823187},"pull_request":{"url":"https://api.github.com/repos/MRChemSoft/mrchem/pulls/161","id":234719331,"node_id":"MDExOlB1bGxSZXF1ZXN0MjM0NzE5MzMx","html_url":"https://github.com/MRChemSoft/mrchem/pull/161","diff_url":"https://github.com/MRChemSoft/mrchem/pull/161.diff","patch_url":"https://github.com/MRChemSoft/mrchem/pull/161.patch","issue_url":"https://api.github.com/repos/MRChemSoft/mrchem/issues/161","number":161,"state":"open","locked":false,"title":"DFT 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the different energy components.\r\n\r\n- [x] Coulomb Hessian\r\n- [x] XC Hessian (LDA)\r\n- [ ] XC Hessian (GGA)\r\n- [ ] Exchange Hessian\r\n- [x] Testing\r\n 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