Outline of FPII[Up][CMSU]
(Start 1/21, 2003)(Update 5/18, 2011)
[Contents][Profiles][Collaboration][Results and Products][SANZEN]
[Purpose]
We perform theoretical research to investigate fundamental properties and elemental processes at reactions and materials formation on the basis of the first-principles electronic structure calculations (Car-Parrinello approach, all-electron methods, Diffusion Monte Carlo, etc.). Staff in this group are actively involved in the development of the basic theory of the computation.
[Method]
- [SANZEN]
- FPMD
- (Plane wave basis + pseudopotential)
- FLAPW
- FP-LMTO
- TB
- QM, Mixed basis
- DMC(QMC)
- Model calculations
[Computer resources]
- SGI Supercomputer (Sengen site)
- No Main Computer (Namiki site)
- WS (Workstation)
- PC
- WS,PC clusters
- Calculator
- Abacus (?) <-- Slide rule (Recently nonuse)
[Address]
[Sengen site] 1-2-1 Sengen, Tsukuba, Ibaraki 305-0047, Japan/Fax. +81-29-859-2029
[Namiki site] 1-1 Namiki, Tsukuba, Ibaraki 305-0044, Japan/Fax. +81-29-852-7449
[CMSU][NIMS][MEXT][Cabinet][UN][Up]
(J):Japanese, Webmaster(K. Kobayashi): kobayashi.kazuaki-@-nims.go.jp :("-@-" --> "@")