{"author_name":"lan496","blog_url":"https://lan496.hatenadiary.jp/","type":"rich","height":"190","blog_title":"lan496\u306e\u65e5\u8a18","provider_url":"https://hatena.blog","description":"pymatgen\u3092\u4f7f\u3046\u3068VASP\u306e\u5165\u529b\u30d5\u30a1\u30a4\u30eb\u3092\u7c21\u5358\u306b\u4f5c\u308b\u3053\u3068\u304c\u3067\u304d\u308b\u304c\u3001\u516c\u5f0f\u30c9\u30ad\u30e5\u30e1\u30f3\u30c8\u306b\u306f\u307e\u3068\u307e\u3063\u305f\u8a18\u8ff0\u304c\u306a\u304b\u3063\u305f\u306e\u3067\u81ea\u5206\u7528\u306b\u5099\u5fd8\u9332\u3092\u6b8b\u3057\u3066\u304a\u304f\u3002 \u6b63\u76f4\u3001pymatgen\u306eAPI\u30c9\u30ad\u30e5\u30e1\u30f3\u30c8\u3092\u8aad\u3081\u3070\u3053\u306e\u8a18\u4e8b\u3092\u8aad\u3080\u5fc5\u8981\u306f\u306a\u3044\u3068\u601d\u3046\u3002 POTCAR http://pymatgen.org/installation.html#potcar-setup \u306b\u5f93\u3063\u3066pymatgen\u304c\u8aad\u3080POTCAR\u306e\u914d\u7f6e\u5834\u6240\u3092\u8a2d\u5b9a\u3059\u308b\u3002 \u307e\u305a\u3001\u4f8b\u3048\u3070VASP\u306b\u4ed8\u5c5e\u3057\u3066\u3044\u308bPOTCAR\u306e\u30c7\u30a3\u30ec\u30af\u30c8\u30ea(<EXTRACTED_VASP_POTCAR>)\u3092<MY_PSP>\u4ee5\u4e0b\u306bpymatgen\u304c\u8aad\u307f\u8fbc\u3081\u308b\u5f62\u5f0f\u3067\u30b3\u30d4\u30fc\u3059\u308b: \u2026","html":"<iframe src=\"https://hatenablog-parts.com/embed?url=https%3A%2F%2Flan496.hatenadiary.jp%2Fentry%2F2018%2F12%2F09%2F233705\" title=\"pymatgen\u3067VASP\u306e\u5165\u529b\u30d5\u30a1\u30a4\u30eb\u3092\u4f5c\u308b - lan496\u306e\u65e5\u8a18\" class=\"embed-card embed-blogcard\" scrolling=\"no\" frameborder=\"0\" style=\"display: block; width: 100%; height: 190px; max-width: 500px; margin: 10px 0px;\"></iframe>","categories":["pymatgen"],"published":"2018-12-09 23:37:05","title":"pymatgen\u3067VASP\u306e\u5165\u529b\u30d5\u30a1\u30a4\u30eb\u3092\u4f5c\u308b","author_url":"https://blog.hatena.ne.jp/lan496/","width":"100%","version":"1.0","url":"https://lan496.hatenadiary.jp/entry/2018/12/09/233705","provider_name":"Hatena Blog","image_url":null}