Electronic States of Nanoscopic Chains and Rings from First Principles: EDABI Method

Autor: R. Zahorbenski, Adam Rycerz, Jan Kurzyk, R. Podsiadły, E. M. Görlich, W. Wójcik, Jozef Spałek
Rok vydání: 2004
Předmět:
Zdroj: Molecular Nanowires and Other Quantum Objects ISBN: 9781402020698
DOI: 10.1007/978-1-4020-2093-3_32
Popis: We summarize briefly the main results obtained within the proposed EDABI method combining Exact Diagonalization of (parametrized) many-particle Hamil-tonian with Ab I nitio self-adjustment of the single-particle wave function in the correlated state of interacting electrons. The properties of nanoscopic chains and rings are discussed as a function of their interatomic distance R and compared with those obtained by Bethe ansatz for infinite Hubbard chain. The concepts of renormalized orbitals, distribution function in momentum space, and of Hubbard splitting as applied to nanoscopic systems are emphasized.
Databáze: OpenAIRE