Study on structural elementary excitations at semiconductor surfaces and interfaces
ISSP Activity Report 2021, p. 129…続きを読む
Systematic analysis of ab initio low-energy effective Hamiltonians for Pd(dmit)2 molecular conductors
ISSP Activity Report 2020, p. 189-190…続きを読む
Development of analysis method for molecular crystal surface using wave number space-resolved photoelectron spectroscopy
ISSP Activity Report 2020, p. 180-181…続きを読む
Ab initio derivation of effective low-energy model of Ca5Ir3O12
ISSP Activity Report 2019, p. 68-69…続きを読む
GW + BSE calculation of RIXS spectra by the all-electron mixed basis program, TOMBO
ISSP Activity Report 2021, p. 68…続きを読む
Mechanisms of Semiconductor Interface Formation and its Electronic Properties based on Quantum Theory
ISSP Activity Report 2020, p. 49-51…続きを読む
Electrochemical reaction analysis using density functional calculation + implicit solvation model 2
ISSP Activity Report 2020, p. 71-72…続きを読む
Extension of susceptibilities, screened exchange and spin-fluctuation integrals into ultrasoft pseudopotentials
ISSP Activity Report 2021, p. 305-306…続きを読む
Mechanism of quantum spin liquid and high-Tc superconductivity studied by excitation spectra and nonequilibrium dynamics calculation by Variational Monte Carlo methods
ISSP Activity Report 2019, p. 197-199…続きを読む
Prediction of properties of organic ferroelectrics and piezoelectrics by first-principles calculation
ISSP Activity Report 2021, p. 121-122…続きを読む