{"action":"created","issue":{"url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/24","repository_url":"https://api.github.com/repos/quanshengwu/wannier_tools","labels_url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/24/labels{/name}","comments_url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/24/comments","events_url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/24/events","html_url":"https://github.com/quanshengwu/wannier_tools/issues/24","id":307517160,"number":24,"title":"Error in running bwannier btools (parallel)","user":{"login":"VijayaShivaprasad","id":37649695,"avatar_url":"https://avatars1.githubusercontent.com/u/37649695?v=4","gravatar_id":"","url":"https://api.github.com/users/VijayaShivaprasad","html_url":"https://github.com/VijayaShivaprasad","followers_url":"https://api.github.com/users/VijayaShivaprasad/followers","following_url":"https://api.github.com/users/VijayaShivaprasad/following{/other_user}","gists_url":"https://api.github.com/users/VijayaShivaprasad/gists{/gist_id}","starred_url":"https://api.github.com/users/VijayaShivaprasad/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/VijayaShivaprasad/subscriptions","organizations_url":"https://api.github.com/users/VijayaShivaprasad/orgs","repos_url":"https://api.github.com/users/VijayaShivaprasad/repos","events_url":"https://api.github.com/users/VijayaShivaprasad/events{/privacy}","received_events_url":"https://api.github.com/users/VijayaShivaprasad/received_events","type":"User","site_admin":false},"labels":[],"state":"open","locked":false,"assignee":null,"assignees":[],"milestone":null,"comments":9,"created_at":"2018-03-22T06:05:37Z","updated_at":"2018-03-28T13:22:18Z","closed_at":null,"author_association":"NONE","body":"Tried running wannier tools using hr_dat generated by VASP, But getting an error \r\nNBANDS in VASP is 50 Total no. of wannier center is also 50 still getting an error\r\n We found wannier_centers card\r\n  \r\n  >>>> Error happens in Wannier_centres card\r\n  Error: the number of wannier_centers lines should \r\n  equal to the number wannier functions (include spin)\r\n  Num_wann          90  the centres lines you given           50\r\n  Otherwise, if you do not know the meaning of this,\r\n  please delete this card\r\n\r\nPlease help with the calculation, Thank You\r\nVijaya\r\n "},"comment":{"url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/comments/376884355","html_url":"https://github.com/quanshengwu/wannier_tools/issues/24#issuecomment-376884355","issue_url":"https://api.github.com/repos/quanshengwu/wannier_tools/issues/24","id":376884355,"user":{"login":"quanshengwu","id":10760633,"avatar_url":"https://avatars0.githubusercontent.com/u/10760633?v=4","gravatar_id":"","url":"https://api.github.com/users/quanshengwu","html_url":"https://github.com/quanshengwu","followers_url":"https://api.github.com/users/quanshengwu/followers","following_url":"https://api.github.com/users/quanshengwu/following{/other_user}","gists_url":"https://api.github.com/users/quanshengwu/gists{/gist_id}","starred_url":"https://api.github.com/users/quanshengwu/starred{/owner}{/repo}","subscriptions_url":"https://api.github.com/users/quanshengwu/subscriptions","organizations_url":"https://api.github.com/users/quanshengwu/orgs","repos_url":"https://api.github.com/users/quanshengwu/repos","events_url":"https://api.github.com/users/quanshengwu/events{/privacy}","received_events_url":"https://api.github.com/users/quanshengwu/received_events","type":"User","site_admin":false},"created_at":"2018-03-28T13:22:18Z","updated_at":"2018-03-28T13:22:18Z","author_association":"OWNER","body":"If the projectors are random. Then, do it like this.\r\n\r\nFind num_wann number in the wannier90.win. For example num_wann=8. Then set projectors like this:\r\n\r\nwhen without soc, set SOC=0 and\r\nPROJECTORS\r\n8\r\nA s s s s s s s s \r\n\r\n\r\nwhen with soc, set SOC=1 and\r\nPROJECTORS\r\n4\r\nA s s s s\r\n\r\n\r\n"}}
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