Распределение валентной электронной плотности в системе титан-водород c вакансией; Перспективы развития фундаментальных наук
| Parent link: | Перспективы развития фундаментальных наук.— 2015.— [С. 230-232] |
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| Huvudupphovsman: | |
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| Sammanfattning: | Заглавие с экрана The results of first-principle calculations of valence electron distribution in the titanium-hydrogen system with vacancy have been presented. The formation of the hydrogen-vacancy subsystems in the Ti-H leads to strongly anisotropic redistribution of the metal charge density. It is shown that the location of hydrogen in the interstitial near the vacancy is characterized by strong chemical binding of hydrogen with titanium. |
| Språk: | ryska |
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2015
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| Serie: | Физика |
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| Länkar: | http://earchive.tpu.ru/handle/11683/19151 http://www.lib.tpu.ru/fulltext/c/2015/C21/066.pdf |
| Materialtyp: | Elektronisk Bokavsnitt |
| KOHA link: | https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=612966 |
| Fysisk beskrivning: | 1 файл(2.1 Мб) |
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| Sammanfattning: | Заглавие с экрана The results of first-principle calculations of valence electron distribution in the titanium-hydrogen system with vacancy have been presented. The formation of the hydrogen-vacancy subsystems in the Ti-H leads to strongly anisotropic redistribution of the metal charge density. It is shown that the location of hydrogen in the interstitial near the vacancy is characterized by strong chemical binding of hydrogen with titanium. |