Коливальні стани кисню на грані (111) силіцію
Results of calculations on vibration of spectra of the adsorption complexes of dioxygen molecule and the products of their transformations on crystalline silicon surface  face(111) are described in the article. Their difference has been shown from those of bulk phase complexes including...
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| Datum: | 2018 |
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| Hauptverfasser: | , , |
| Format: | Artikel |
| Sprache: | Ukrainisch |
| Veröffentlicht: |
Chuiko Institute of Surface Chemistry National Academy of Sciences of Ukraine
2018
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| Online Zugang: | https://surfacezbir.com.ua/index.php/surface/article/view/325 |
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| Назва журналу: | Surface |
| Завантажити файл: |  |
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Surface| Zusammenfassung: | Results of calculations on vibration of spectra of the adsorption complexes of dioxygen molecule and the products of their transformations on crystalline silicon surface  face(111) are described in the article. Their difference has been shown from those of bulk phase complexes including interstitial oxygen atoms. Calculations were carried out using density functional theory method with the 6-31G** basis set within the cluster approximation. |
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