Masahiko Katagiri
National Institute for Materials Science (NIMS)
Computational Materials Science Center (CMSC)





Scientific Programs and Links

Education

PhD, degree from Tohoku University (March 1993)
Solvation Structure of Supercritical Dilute Solutions
Department of Molecular Chemistry and Engineering, Faculty of Engineering
Tohoku University (Prof. Minoru Tanaka)
 

Collaboration

Dr. Ali Alavi

Department of Chemistry, Cambridge University
Lensfield Road, Cambridge, CB2 1EW, UK
photos of Ali's group

photos of the members of theoretical sector

@

Prof. Mike W. Finnis and Prof. Ruth M. Lynden-Bell
Atomistic Simulation Group
School of Mathematics and Physics
The Queen's University of Belfast
Belfast BT7 1NN, Northern Ireland (UK)

@

Prof. Akira Miyamoto

Department of Molecular Chemistry and Engineering
Faculty of Engineering
Tohoku University
Aoba, Aramaki, Aoba, Sendai 980-77, Japan

 

Prof. Minoru Tanaka

Department of Molecular Chemistry and Engineering
Faculty of Engineering
Tohoku University
Aoba, Aramaki, Aoba, Sendai 980-77, Japan

@

Prof. David L. Patrick

Department of Chemistry
Western Washington University
Bellingham, WA 98225, USA

@

Prof. John M. Newsam

Managing Director
fcubed (HTE)
6540 Lusk Blvd, Suite C276, San Diego, CA 92121, U.S.A.

@

Research Interests

Molecular Dynamics Simulation of Hydrogen-Induced Amorphization  

Hydrogen Storage Materials

Theoretical Materials Design

Semi-Empirical Potential Functions of Inorganic Materials

Oxide-Metal Interfaces

Molecular Dynamics

Density Functional Theory

Current Projects

Computer Simulation of Hydrogen Storage Materials -  Molecular Dynamics and Quantum Chemical Study

Molecular Dynamics Study of Hydrogen-Induced Amorphization -  Classical Atomic Size Effect in Amorphization

Development of Code for Oxide-Metal Interfaces using Discrete Classical Model (DCM) with Embedded-Atom Method and Polarizable-Ion Model

Scientific Papers

Conferences  

Reviews and Books

Links

Private Photos

@

  Address:

Dr. Masahiko Katagiri

National Institute for Materials Science (NIMS)
Computational Materials Science Center
Particle Simulation and Thermodynamics Group

1-2-1 Sengen, Tsukuba, Ibaraki 305-0047, Japan  

Ћˁ@F

@Ɨs@l@Eޗ@\
@vZȊwZ^[
@qEvM͊wO[v

@305-0047@錧‚Ύs猻1-2-1

(0) 29-859-2631
(0) 29-859-2601

Email: KATAGIRI.Masahiko@nims.go.jp  

http://www.nims.go.jp/cmsc/pst/katagiri


Masa Katagiri Home Page | NIMS Home Page | Scientific Links | Fun | Queen's University of Belfast | ASG | library | HENSA Archives | Yahoo! UK & Ireland | CODATA | Yinon Bentor's Periodic Table |


revised 2007/12/11