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1. Element-selective structural visualization for the oxygen-induced surface of Nb⁡(110)

Description/Abstract:: The highest superconducting transition temperature in Nb among elemental materials facilitates applications of superconducting junctions....
Keyword:: AFM, DFT, Nb(110), and STM
Resource Type:: Article
Author:: Yuuki Yasui, Katsuyuki Matsunaga, Keisuke Sagisaka, and Yoshiaki Sugimoto
Journal:: Physical Review B
Date Uploaded:: 28/05/2024

2. Numerical atomic basis orbitals from H to Kr

Description/Abstract:: We present a systematic study for numerical atomic basis orbitals ranging from H to Kr, which could be used in large scale O(N) electroni...
Keyword:: DFT, LCAO, OpenMX, benchmark, bulks, first-principles calculation, molecules, and numerical atomic basis
Resource Type:: Article
Author:: T. Ozaki and H. Kino
Date Uploaded:: 28/04/2023