KAWAMURA Laboratory

[Japanese]

Clay molecule (beidellite) in water by means of molecular dynamics simulation

[Fundamentals of Molecular Simulation: Algolithm and Interatomic Interaction]

Modeling of interaction between atoms and molecules

Method and algolithm: MD, MC, ensemble, computer code

Large scale molecular simulation: Haed ans soft ware

Complex systems: Organic-Inorganic system, multi-component multi-phase system

[Applications of Molecular Simulations]

Clay-Water/solution system

Zeolite-gas/organic molecule system

Gas hydrates

[Experimental Studies]

In-situ environmental x-ray diffraction up to 200 C and 1 atm of P(H2O)

High temperature (up to 1500 C) behavior of clay minerals, zeolite etc.

In-situ X-ray diffraction of clay under one dimensional consolidation

Development of in-situ x-ray diffraction sytem at 400 C and 200 atm