{"id":3262,"date":"2025-01-15T14:41:39","date_gmt":"2025-01-15T13:41:39","guid":{"rendered":"https:\/\/kmplg.sk\/?page_id=3262"},"modified":"2025-07-21T14:55:02","modified_gmt":"2025-07-21T12:55:02","slug":"theocrystmin","status":"publish","type":"page","link":"https:\/\/kmplg.sk\/?page_id=3262","title":{"rendered":"TheoCrystMin"},"content":{"rendered":"\n

Z\u00e1kladn\u00e9 inform\u00e1cie o projekte<\/a><\/p>\n\n\n\n

Teoretick\u00e9 z\u00e1klady<\/a> <\/p>\n\n\n\n

Program BoVaToM<\/a><\/p>\n\n\n\n

<\/p>\n\n\n\n

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Projekt 09I03-03-V04-00060 Application of modern analytical and theoretical methods in the crystal-chemical study of minerals (Aplik\u00e1cia modern\u00fdch analytick\u00fdch a teroretick\u00fdch met\u00f3d v kry\u0161talochemickom \u0161t\u00fadiu miner\u00e1lov)<\/p>\n\n\n\n

Identifik\u00e1cia v\u00fdskumn\u00edka<\/strong><\/td>Peter Ba\u010d\u00edk<\/td><\/tr>
Typ podpory\/f\u00e1za kari\u00e9ry<\/strong><\/td>C) \u0160tipendium v\u00fdskumn\u00edka R4<\/td><\/tr>
Vedn\u00e1 oblas\u0165<\/strong><\/td>Pr\u00edrodn\u00e9 a lek\u00e1rske vedy<\/td><\/tr><\/tbody><\/table><\/figure>\n\n\n\n
N\u00e1zov programu:<\/strong><\/td>Pl\u00e1n obnovy a odolnosti SR<\/td><\/tr>
Komponent:<\/strong><\/td>9. Efekt\u00edvnej\u0161ie riadenie a posilnenie financovania v\u00fdskumu, v\u00fdvoja a inov\u00e1ci\u00ed Pl\u00e1nu obnovy a odolnosti Slovenskej republiky<\/td><\/tr>
Invest\u00edcia:<\/strong><\/td>3. Excelentn\u00e1 veda<\/td><\/tr><\/tbody><\/table><\/figure>\n\n\n\n

Anot\u00e1cia projektu<\/strong><\/h2>\n\n\n\n

Hlavn\u00fdm cie\u013eom projektu je vytvorenie robustn\u00e9ho teoretick\u00e9ho z\u00e1kladu pre popis \u0161trukt\u00farnych vlastnost\u00ed a kry\u0161talochemick\u00fdch vlastnost\u00ed a procesov v miner\u00e1loch. Miner\u00e1ly, na rozdiel od syntetick\u00fdch materi\u00e1lov, s\u00fa takmer v\u017edy tuh\u00e9 roztoky dvoch alebo viacer\u00fdch koncov\u00fdch zlo\u017een\u00ed. Teoretick\u00e9 mineralogick\u00e9 \u0161t\u00fadium je zalo\u017een\u00e9 na nieko\u013ek\u00fdch r\u00f4znych pr\u00edstupoch, ale v kry\u0161taloch\u00e9mii miner\u00e1lov je najn\u00e1dejnej\u0161ia kombin\u00e1cia \u0161trukt\u00farnej a v\u00e4zbovej topol\u00f3gie a te\u00f3rie mocenstva v\u00e4zieb. Tento pr\u00edstup umo\u017e\u0148uje predikciu a anal\u00fdzu v\u00e4zbov\u00fdch vlastnost\u00ed v r\u00f4znych \u0161trukt\u00farach miner\u00e1lov a ur\u010denie \u00fa\u010dinkov substit\u00faci\u00ed na lok\u00e1lnu \u0161trukt\u00faru aj dlh\u0161iu vzdialenos\u0165. Navy\u0161e v spojen\u00ed s in\u00fdmi pr\u00edstupmi, ako je te\u00f3ria ligandov\u00e9ho po\u013ea, by mohla zlep\u0161i\u0165 interpret\u00e1ciu a predikciu spektroskopick\u00fdch vlastnost\u00ed miner\u00e1lov. Preto sa na overenie teoretick\u00fdch predpoved\u00ed bude aplikova\u0165 \u0161irok\u00e9 spektrum analytick\u00fdch met\u00f3d. V\u00fdskum sa podrobne zameria na \u0161pecifick\u00e9 probl\u00e9my v r\u00f4znych oxidick\u00fdch miner\u00e1loch (silik\u00e1ty, oxidy, fosfore\u010dnany), ale aj na v\u00fdvoj funk\u010dnej te\u00f3rie a softv\u00e9ru vo v\u0161eobecnosti. V\u00fdsledky projektu by mali \u0161irok\u00e9 uplatnenie od z\u00e1kladnej mineral\u00f3gie a\u017e po aplik\u00e1cie ako gemol\u00f3gia, fyzika materi\u00e1lov a technol\u00f3gie zalo\u017een\u00e9 na vyu\u017eit\u00ed miner\u00e1lov.<\/p>\n\n\n\n

V\u00fdskumn\u00fd t\u00edm<\/h2>\n\n\n\n
Ved\u00faci t\u00edmu<\/strong><\/td>doc. RNDr. Peter Ba\u010d\u00edk, PhD.<\/a><\/td><\/tr>
\u010clenky t\u00edmu<\/strong><\/td>doc. RNDr. Jana Fridrichov\u00e1, PhD.<\/a>
MSc. Olena Rybnikova, PhD.<\/a>
Mgr. Petra Kardo\u0161ov\u00e1<\/td><\/tr><\/tbody><\/table><\/figure>\n\n\n\n

Publik\u00e1cie v r\u00e1mci projektu<\/strong><\/h2>\n\n\n\n

Pripravovan\u00e9<\/h3>\n\n\n\n

Ba\u010d\u00edk P., 2025: The bond-topological field modeling I: The bond-topological map of dravite from Forshammar, Sweden. American Mineralogist<\/em>, in prep.<\/em><\/p>\n\n\n\n

Ertl A., Ba\u010d\u00edk P., 2025: How Li can be incorporated into the structure of Al-rich tourmaline. Mineralogical Magazine<\/em>, in prep<\/em>.<\/p>\n\n\n\n

Ba\u010d\u00edk P., 2025: The bond-topological field modeling II: The bond-topological fields and determination of structural effects on an example of the tetrahedral substitutions in tourmaline-supergroup minerals. American Mineralogist<\/em>, in prep.<\/em><\/p>\n\n\n\n

Financovan\u00e9 Eur\u00f3pskou \u00faniou z prostriedkov Pl\u00e1nu obnovy a odolnosti SR<\/h2>\n\n\n\n
\"\"<\/figure>\n","protected":false},"excerpt":{"rendered":"

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