Написати автору Атоми впровадження у кристалічній гексагональній структурі
DOI: https://doi.org/10.15407/hftp14.02.210
Анотація
В рамках роботи розглянуто гексагональну структуру металів типу В19 як сорбентів водню. Розглядаються кристалічні ґгатки, де в міжвузлі металу впроваджуються атоми домішок (водень). Для цього у роботі наведено зображення самої структури В19. В роботі вивчено розчинність водню в кристалічній структурі металів типу В19, використовуючи метод конфігурацій, а також знайдено в заміщенні вузлів і міжвузлів залежність від складу сплаву та температури. Також розглянуто ступінь далекого порядку у вузлах та визначено параметри кореляції у заміщенні. Наведено графічний вигляд впливу атомного порядку на розчинність домішок. Розрахункові дані, які отримані у роботі, збігаються з експериментальними даними інших досліджень, а отримані формули розрахунків дозволяють визначити енергетичні параметри сплавів, що мають певну наукову цінність. Запропонована система враховує лише атомну взаємодію та абсорбцію (розчинення), дифузію атомів впровадження в об’єм кристалічної структури, тому можна прогназувати введення лише атомa водню). Таким чином, отримані в роботі результати щодо параметрів кореляції при розподілі атомів лише в октапорах або лише в тетрапорах дозволяють глибше вивчати фізичні характеристики сплавів типу В19 і зрозуміти процеси сорбції водню робочими тілами для накопичувачів водню.
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DOI: https://doi.org/10.15407/hftp14.02.210
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