{"id":2053,"date":"2024-05-10T19:46:47","date_gmt":"2024-05-10T10:46:47","guid":{"rendered":"https:\/\/matlantis.com\/?post_type=calculation&#038;p=2053"},"modified":"2025-11-17T10:55:44","modified_gmt":"2025-11-17T01:55:44","slug":"calculation-of-hildebrand-solubility-parameters","status":"publish","type":"calculation","link":"https:\/\/matlantis.com\/ja\/calculation\/calculation-of-hildebrand-solubility-parameters\/","title":{"rendered":"Hildebrand\u6eb6\u89e3\u5ea6\u30d1\u30e9\u30e1\u30fc\u30bf\u306e\u7b97\u51fa"},"content":{"rendered":"<div class=\"calculation-imagebox\">\n\t<div class=\"calculation-imagebox-texts\">\n\t\t<h2>\u30c6\u30fc\u30de\u6982\u8981<\/h2>\n\t\t<p><p>Hildebrand \uff08\u30d2\u30eb\u30c7\u30d6\u30e9\u30f3\u30c9\uff09\u306e\u6eb6\u89e3\u5ea6\u30d1\u30e9\u30e1\u30fc\u30bf\uff08solubility parameter, SP\u5024, \u03b4\uff09\u306f\u3001\u84b8\u767a\u71b1\u3092\u6bd4\u4f53\u7a4d\u3067\u898f\u683c\u5316\u3057\u305f\u5024\u3067\u3059[1]\u3002\u5024\u304c\u8fd1\u3044\u5316\u5408\u7269\u307b\u3069\u4e92\u3044\u306b\u76f8\u6eb6\u3057\u3084\u3059\u3044\u3068\u3044\u3046\u3053\u3068\u304c\u7d4c\u9a13\u7684\u306b\u77e5\u3089\u308c\u3066\u304a\u308a\u3001\u84b8\u767a\u71b1\u3084\u6bd4\u4f53\u7a4d\u3068\u3044\u3063\u305f\u6bd4\u8f03\u7684\u5b9f\u9a13\u3084MD\u8a08\u7b97\u304b\u3089\u6e2c\u5b9a\u3057\u3084\u3059\u3044\u7269\u6027\u5024\u304b\u3089\u7b97\u51fa\u3067\u304d\u308b\u305f\u3081\u3001\u6750\u6599\u958b\u767a\u304b\u3089\u5275\u85ac\u307e\u3067\u5e45\u5e83\u3044\u5206\u91ce\u3067\u5229\u7528\u3055\u308c\u3066\u3044\u307e\u3059\u3002<\/p>\n<p>\u3053\u306e\u4e8b\u4f8b\u3067\u306f\u30017\u7a2e\u985e\u306e\u4f4e\u5206\u5b50\u6709\u6a5f\u5316\u5408\u7269\u306e\u30d2\u30eb\u30c7\u30d6\u30e9\u30f3\u30c9\u6eb6\u89e3\u5ea6\u30d1\u30e9\u30e1\u30fc\u30bf\u3092Matlantis\u3067\u8a08\u7b97\u3057\u3001\u5b9f\u9a13\u5024[2,3]\u304a\u3088\u3073GAFF\u529b\u5834\u306b\u3088\u308b\u8a08\u7b97\u7d50\u679c[4]\u3068\u6bd4\u8f03\u3057\u307e\u3057\u305f\u3002<\/p>\n<p>\u672c\u8a08\u7b97\u4e8b\u4f8b\u306e\u30b5\u30f3\u30d7\u30eb\u30b9\u30af\u30ea\u30d7\u30c8\u306fmatlantis-contrib\u4e0a\u3067\u516c\u958b\u3055\u308c\u3066\u3044\u307e\u3059\u3002<br \/>\n\u30fb<a href=\"https:\/\/github.com\/matlantis-pfcc\/matlantis-contrib\/tree\/main\/matlantis_contrib_examples\/solubility_parameter\" rel=\"nofollow noopener\" target=\"_blank\">https:\/\/github.com\/matlantis-pfcc\/matlantis-contrib\/tree\/main\/matlantis_contrib_examples\/solubility_parameter<\/a><\/p>\n<\/p>\n\t<\/div>\n\t<div class=\"calculation-imagebox-image\">\n\t\t<figure><img decoding=\"async\" src=\"https:\/\/matlantis.com\/wp-content\/uploads\/2024\/05\/eyecatch_Xability.png\" alt=\"image\"><\/figure>\n\t<\/div>\n<\/div>\n\n<div class=\"calculation-imagebox\">\n\t<div class=\"calculation-imagebox-texts\">\n\t\t<h2>\u8a08\u7b97\u30e2\u30c7\u30eb\u3068\u8a08\u7b97\u65b9\u6cd5<\/h2>\n\t\t<p><p>\u4eca\u56de\u8a08\u7b97\u3057\u305f\u7269\u8cea\u3092\u56f3\u306b\u793a\u3057\u307e\u3057\u305f\u3002<\/p>\n<p>SP\u5024\u306f\u56f3\u306e\u5f0f\u306b\u5f93\u3063\u3066\u7b97\u51fa\u3057\u307e\u3057\u305f\u3002\u3053\u3053\u3067\u3001E<sub>vapor<\/sub>\u3001E<sub>liquid<\/sub>\u306f\u305d\u308c\u305e\u308c\u6c17\u76f8\u3001\u304a\u3088\u3073\u3001\u6db2\u76f8\u306e1\u5206\u5b50\u3042\u305f\u308a\u306e\u30dd\u30c6\u30f3\u30b7\u30e3\u30eb\u30a8\u30cd\u30eb\u30ae\u30fc\u3001\u03c1\u306fNPT\u8a08\u7b97\u3067\u7b97\u51fa\u3057\u305f\u5e73\u5747\u5bc6\u5ea6\u3001M\u306f\u5206\u5b50\u91cf\u3067\u3059\u3002\u3008\u3009\u306f\u30a2\u30f3\u30b5\u30f3\u30d6\u30eb\u5e73\u5747\u3092\u8868\u3057\u307e\u3059\u3002MD\u8a08\u7b97\u306e\u8a08\u7b97\u6761\u4ef6\u306f\u8868\u306b\u793a\u3057\u305f\u901a\u308a\u3067\u3001MD\u8a08\u7b97\u5b9f\u884c\u524d\u306b\u30a8\u30cd\u30eb\u30ae\u30fc\u6975\u5c0f\u5316\u8a08\u7b97\u3092\u5b9f\u65bd\u3057\u3066\u3044\u307e\u3059\u3002<\/p>\n<p>\u7cfb\u306e\u30e2\u30c7\u30ea\u30f3\u30b0\u306b\u306fWinmostar[5]\u3092\u7528\u3044\u307e\u3057\u305f\u3002<\/p>\n<\/p>\n\t<\/div>\n\t<div class=\"calculation-imagebox-image\">\n\t\t<figure><img decoding=\"async\" src=\"https:\/\/matlantis.com\/wp-content\/uploads\/2024\/10\/Fig2_Xability_equations-1.png\" alt=\"image\"><\/figure>\n\t<\/div>\n<\/div>\n\n<div class=\"calculation-imagebox\">\n\t<div class=\"calculation-imagebox-texts\">\n\t\t<h2>\u8a08\u7b97\u7d50\u679c\u3068\u5c55\u671b<\/h2>\n\t\t<p><p>\u56f3\u3068\u8868\u306b\u5b9f\u9a13\u5024[2, 3]\u3068\u8a08\u7b97\u5024[2, 4]\u3068\u3092\u6bd4\u8f03\u3057\u305f\u5404\u7269\u8cea\u306e\u30d2\u30eb\u30c7\u30d6\u30e9\u30f3\u30c8\u6eb6\u89e3\u5ea6\u30d1\u30e9\u30e1\u30fc\u30bf\u306e\u7d50\u679c\u3092\u793a\u3057\u307e\u3059\u3002\u56f3\u306eR<sup>2<\/sup>\u306f\u5b9f\u9a13\u5730\u3068\u306e\u6c7a\u5b9a\u4fc2\u6570\u3067\u3059\u3002\u3053\u306e\u4e8b\u4f8b\u3067\u306f\u3001PFP\u306b\u3088\u308bSP\u5024\u306e\u307b\u3046\u304cGAFF\u3088\u308a\u3082\u826f\u3044\u5b9f\u9a13\u3068\u306e\u76f8\u95a2\u3092\u793a\u3057\u307e\u3057\u305f\u3002<\/p>\n<\/p>\n\t<\/div>\n\t<div class=\"calculation-imagebox-image\">\n\t\t<figure><img decoding=\"async\" src=\"https:\/\/matlantis.com\/wp-content\/uploads\/2024\/10\/Fig3_Xability_equations.png\" alt=\"image\"><\/figure>\n\t<\/div>\n<\/div>\n\n<div class=\"calculation-imagebox\">\n\t<div class=\"calculation-imagebox-texts\">\n\t\t<h2>\u8a08\u7b97\u6761\u4ef6<\/h2>\n\t\t<p><\/p>\n\t<\/div>\n\t<div class=\"calculation-imagebox-image\">\n\t\t<figure><img decoding=\"async\" src=\"https:\/\/matlantis.com\/wp-content\/uploads\/2024\/10\/Fig_4_Xability_condition_ja.png\" alt=\"image\"><\/figure>\n\t<\/div>\n<\/div>\n\n\n<h2 class=\"wp-block-heading\">\u53c2\u8003\u6587\u732e<\/h2>\n\n\n<small>[1] J. H. Hildebrand and R. L. Scott, \u201cSolubility of Nonelectrolytes\u201d 3rd ed., Reinhold, NewYork (1958)<\/small>\n\n<small>[2] J. Comp. Chem., 25, 1814 (2004)<\/small>\n\n<small>[3] J. Appl. Polym. Sci., 116, 1 (2010)<\/small>\n\n<small>[4] <a href=\"https:\/\/winmostar.com\/jp\/case\/calc_hildebrand.pdf\" rel=\"nofollow noopener\" target=\"_blank\">https:\/\/winmostar.com\/jp\/case\/calc_hildebrand.pdf<\/a><\/small>\n\n<small>[5] \u682a\u5f0f\u4f1a\u793e\u30af\u30ed\u30b9\u30a2\u30d3\u30ea\u30c6\u30a3 Winmostar, <a href=\"https:\/\/winmostar.com\/en\/\" rel=\"nofollow noopener\" target=\"_blank\">https:\/\/winmostar.com\/en\/<\/a><\/small>\n\n\n<h2 class=\"wp-block-heading\">\u4e8b\u4f8b\u63d0\u4f9b\u8005\u30d7\u30ed\u30d5\u30a3\u30fc\u30eb<\/h2>\n\n\n\n<!-- \u30d7\u30ed\u30d5\u30a3\u30fc\u30eb\u7d39\u4ecb -->\n          <div class=\"company-profile\">\n            <div class=\"company-profile__content\">\n              <h2 class=\"company-profile__name\">\u682a\u5f0f\u4f1a\u793e\u30af\u30ed\u30b9\u30a2\u30d3\u30ea\u30c6\u30a3<\/h2>\n            <\/div>\n            <div class=\"company-profile__media\">\n              <img decoding=\"async\" src=\"\/wp-content\/uploads\/2024\/05\/X-ability_logo_small-1.png\" alt=\"\u4f01\u696d\u30ed\u30b4\">\n            <\/div>\n          <\/div>\n          <!-- \u3053\u3053\u307e\u3067\u3000\u30d7\u30ed\u30d5\u30a3\u30fc\u30eb\u7d39\u4ecb -->\n","protected":false},"featured_media":2123,"template":"","meta":{"_acf_changed":true},"calculation_category":[23],"class_list":["post-2053","calculation","type-calculation","status-publish","has-post-thumbnail","hentry","calculation_category-polymers"],"acf":[],"_links":{"self":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/calculation\/2053","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/calculation"}],"about":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/types\/calculation"}],"wp:featuredmedia":[{"embeddable":true,"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/media\/2123"}],"wp:attachment":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/media?parent=2053"}],"wp:term":[{"taxonomy":"calculation_category","embeddable":true,"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/calculation_category?post=2053"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}