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Projektowanie molekularne i materiałów

Projektowanie molekularne i materiałów

Nadezhda Andreeva / Vitaly Chaban

76,44 €
IVA incluido
Disponible
Editorial:
KS OmniScriptum Publishing
Año de edición:
2025
Materia
Química física
ISBN:
9786209222535
76,44 €
IVA incluido
Disponible

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Koncepcja krajobrazu energii potencjalnej (PEL) odgrywa kluczową rolę w zrozumieniu mikroskopijnych wzorów i skrupulatnej inżynierii nowych struktur chemicznych. Ta zwięzła książka analizuje historyczną ewolucję koncepcji PEL i jej różnorodne zastosowania w projektowaniu materiałów. Opisowi dostępnych algorytmów teoretycznych towarzyszy krytyczna dyskusja, podkreślająca istotne współczesne wysiłki badawcze, takie jak dostrajanie właściwości strukturalnych i transportowych elektrolitu, poprawa wydajności i obniżenie kosztów pochłaniaczy gazu oraz tworzenie bardziej zrównoważonych projektów urządzeń do magazynowania energii. Omówiono konkretne zastosowania PEL do usystematyzowania wysiłków związanych z projektowaniem molekularnym. Monografia stanowi niezbędne wprowadzenie do nowoczesnego projektowania materiałów in silico i projektowania molekularnego dla studentów i eksperymentatorów zajmujących się chemią i fizyką.

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