Ab initio analysis on the stability of magnetic ternary alloys
ISSP Activity Report 2020, p. 81…Read More
First-principles Calculation of Electric Field Effects in Spin-to-charge Conversion Materials
ISSP Activity Report 2020, p. 150…Read More
Study on structural elementary excitations at semiconductor surfaces and interfaces
ISSP Activity Report 2020, p. 166…Read More
Electrochemical reaction analysis using density functional calculation + implicit solvation model 2
ISSP Activity Report 2020, p. 71-72…Read More
Noisy simulations of first-principles calculations using quantum classical hybrid algorithms
ISSP Activity Report 2020, p. 147-148…Read More
Systematic analysis of ab initio low-energy effective Hamiltonians for Pd(dmit)2 molecular conductors
ISSP Activity Report 2020, p. 189-190…Read More
First-principles study on complexes of impurity and dislocation in GaN p-n diodes
ISSP Activity Report 2020, p. 170…Read More
Mechanisms of Semiconductor Interface Formation and its Electronic Properties based on Quantum Theory
ISSP Activity Report 2020, p. 49-51…Read More
First-principles study of molecule/metal interfaces
ISSP Activity Report 2020, p. 122…Read More
Quantum Simulations on Dynamical Heterogeneous Catalysts
ISSP Activity Report 2020, p. 61-62…Read More