Anionic Germanium–Niobium Clusters: Atomic Structure, Mechanisms of Cluster Formation, and Electronic Spectra
- Авторлар: Borshch N.1, Kurganskii S.2
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Мекемелер:
- Voronezh State Technical University
- Voronezh State University
- Шығарылым: Том 92, № 9 (2018)
- Беттер: 1720-1726
- Бөлім: Structure of Matter and Quantum Chemistry
- URL: https://journals.rcsi.science/0036-0244/article/view/170122
- DOI: https://doi.org/10.1134/S0036024418090078
- ID: 170122
Дәйексөз келтіру
Аннотация
Results from optimizing the atomic structure of anionic clusters \({\text{NbGe}}_{n}^{ - }\) (n = 8−20) are presented, along with their calculated electronic spectra. The calculations are performed within the density functional theory. The real spatial structures of the clusters are determined by comparing the calculated and known experimental data.
Негізгі сөздер
Авторлар туралы
N. Borshch
Voronezh State Technical University
Хат алмасуға жауапты Автор.
Email: n.a.borshch@ya.ru
Ресей, Voronezh, 394000
S. Kurganskii
Voronezh State University
Email: n.a.borshch@ya.ru
Ресей, Voronezh, 394036