Surface Structure Analysis and Atomic Force Microscopy Simulation Using DFT
ISSP Activity Report 2024, p. 16-23…Read More
Ab initio calculation of the rotation effect of oxygen octahedron in Ca2MnO4 on electronic properties
ISSP Activity Report 2024, p. 143-144…Read More
Free-energy evaluation of alloys
ISSP Activity Report 2024, p.86…Read More
All-atomic molecular dynamics simulation for vitrimers
ISSP Activity Report 2024, p. 282-284…Read More
Phase transformation and electric state of high entropy alloys
ISSP Activity Report 2024, p. 159…Read More
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…Read More