activity
19992026
most citedEfficient implementation of the nonequilibrium Green function method for electronic transport calculations

194 citations · 1.5k across the 46 of their papers we have counts for

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Showing 2020Show all

7 papers · 1 filter

cond-mat.mtrl-sci2020★ 2 cited

Scaling law for the Rashba-type spin splitting in quantum well films

Ryo Noguchi, Kenta Kuroda, Mitsuaki Kawamura +7

We use laser-based spin- and angle-resolved photoemission spectroscopy (laser-SARPES) with high-resolution, and experimentally determine, for the first time, the Rashba-parameters…

cond-mat.mtrl-sci2020★ 20 cited

Densest binary sphere packings and phase diagram : revisited

Ryotaro Koshoji, Mitsuaki Kawamura, Masahiro Fukuda +1

We revisit the densest binary sphere packings (DBSP) under the periodic boundary conditions and present an updated phase diagram, including newly found 12 putative densest structur…

cond-mat.mtrl-sci2020★ 21 cited

First-principles study on the stability and electronic structure of monolayer GaSe with trigonal-antiprismatic structure

Hirokazu Nitta, Takahiro Yonezawa, Antoine Fleurence +2

The structural stability and electronic states of GaSe monolayer with trigonal-antiprismatic (AP) structure, which is a recently discovered new polymorph, were studied by first-pri…

cond-mat.mtrl-sci2020★ 6 cited

Unfolding optical transition weights of impurity materials for first-principles LCAO electronic structure calculations

Yung-Ting Lee, Chi-Cheng Lee, Masahiro Fukuda +1

A method to analyze optical transitions is developed by combining the Kubo-Greenwood formula with the unfolding method to construct an unfolded electronic band structure with optic…

cond-mat.mtrl-sci2020

Single-site orthogonalization for first-principles computations of exchange coupling constants

Asako Terasawa, Sonju Kou, Taisuke Ozaki +1

For accurate first-principles computations of exchange coupling constants by the Liechtenstein method with localized basis sets, we developed a scheme using the single-sit…

cond-mat.mtrl-sci2020★ 9 cited

Electronic structure of a 3x3-ordered silicon layer on Al(111)

Y. Sato, Y. Fukaya, M. Cameau +11

Electronic structure of the 3x3 ordered-phase of a silicon (Si) layer on Al(111) has been studied by angle resolved photoemission spectroscopy (ARPES) technique using synchrotron r…

cond-mat.str-el2020★ 9 cited

Emergence of Nearly Flat Bands through an Embedded Kagome Lattice in an Epitaxial Two-dimensional Ge Layer on ZrB2(0001)

Antoine Fleurence, Chi-Cheng Lee, Rainer Friedlein +8

Ge atoms segregating on zirconium diboride thin films grown on Ge(111) were found to crystallize into a two-dimensional bitriangular structure which was recently predicted to be a…