Structure analysis of atomic layer alloy with Rashba effect studied by TRHEPD
ISSP Activity Report 2024, p. 358-359…続きを読む
Massively parallel variational Monte Carlo method for excitation spectra augmented by artificial neural networks
ISSP Activity Report 2024, p. 217…続きを読む
GW + BSE photoabsorption spectra of transition metal doped TiO2 and excited-state TDGW-MD simulation of CH4 + Ni
ISSP Activity Report 2024, p. 79…続きを読む
Understanding Fast Ion Conduction in Inhomogeneous Materials
ISSP Activity Report 2024, p. 358-359…続きを読む
Surface Structure Analysis and Atomic Force Microscopy Simulation Using DFT
ISSP Activity Report 2024, p. 16-23…続きを読む
Development of Fast Calculation Codes of Berry Phases in First-principles Calculations and its Application to Energy Conversion Materials
ISSP Activity Report 2024, p. 131…続きを読む
Phase transformation and electric state of high entropy alloys
ISSP Activity Report 2024, p. 159…続きを読む
Modeling ultrafast electron dynamics: Case studies of elemental metals and carbon nanostructures
ISSP Activity Report 2024, p. 152…続きを読む
Ferromagnetism in CeRh6Ge4: A DFT+DMFT study
ISSP Activity Report 2024, p. 238…続きを読む
Ab initio calculation of the rotation effect of oxygen octahedron in Ca2MnO4 on electronic properties
ISSP Activity Report 2024, p. 143-144…続きを読む