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Computational Structural Materials Group
Members
Ryoji Sahara
Group Leader, Computational Structural Materials Group, Materials Evaluation Field, Research Center for Structural Materials
Keyword : computational materials science, structural materials, monte carlo method, phase-field method, all-electron GW calculation, oxidation
Ikuo Ohnuma
Chief Researcher, Computational Structural Materials Group, Materials Evaluation Field, Research Center for Structural Materials
Keyword : phase diagram, CALPHAD, diffusion multiple, combinatorial method, lattice defect segregation calculation system, segregation engineering
About us
We are responsible for improving the accuracy of prediction of material properties in the field of computational materials science and accelerating development of materials. By combining the fundamental laws of physics, simulation methods over a wide range of time and spatial scales, experiments, and data science, we aim to dramatically improve the ability of prediction properties in materials using DX, and clarify a mechanisms and accelerating materials development.
Specialized Research Field
To investigate various stages of phase transformation and micorstructure formation in materials from atomic to macroscopic point of view, we perform a variety of simulation techniques such as ab initio, molecular dynamics (MD), Monte Carlo (MC) method, cluster variation method, CALPHAD method, and phase-field method, having strong collaboration with experiment.