Materials Transactions Online

Material Transaction, JIM, Vol.40 No.11 (1999)

1186-1192 :
Acceleration of Self-Consistent Electronic-Structure Calculations: Storage-Saving and Multiple-Secant Implementation of the Broyden Method
Akitaka Sawamura, Masanori Kohyama, Tomohiro Keishi and Mikio Kaji
1193-1197 :
Ab-initio Calculations of Sodium Segregation in Aluminum Grain Boundaries
Akira Suzuki, Guang Hong Lu, Akira Itoh,
Masanori Kohyama and Ryoichi Yamamoto
1198-1204 :
Bonding Nature of Si7 Bicapped Pentagon Cluster: Ab-initio Study
Haruki Eguchi, Kazuo Tsumuraya, Takatoshi Nagano
and Shigemitsu Kihara
1205-1208 :
All-Electron Mixed-Basis Calculation with Conjugated Gradient Method to Optimize Structure of Copper Clusters
Y. C. Bae, Kaoru Ohno and Yoshiyuki Kawazoe
1209-1212 :
Dielectric Response Functions Studied by an All-Electron Mixed-Basis Approach
Soh Ishii, Kaoru Ohno and Yoshiyuki Kawazoe
1213-1218 :
Atomic Structure of Pd-Intercalated Graphite by High-Resolution Electron Microscopy and First Principles Calculations
Takeo Oku, Qiang Sun, Ding-Sheng Wang, Qian Wang,
Yoshiyuki Kawazoe, Günter Schmid and Katsuaki Suganuma
1219-1223 :
Targeting the Development of a Virtual Microscope
Toshikazu Takada, Jiro Shimada, Yasuharu Okamoto, Yukio Hirahara,
Toshihiro Sakuma, Hiroshi Nakada, Tadashi Murase, Hajime Ishii,
Kiyoshi Matsubara, Akifumi Kato, Shun'ichi Sukemura, Hideaki Koike,
Satoshi Sekiguchi and Tosiro Osaka
1224-1227 :
Capacitance of Microclusters
Q. Wang, Q. Sun, Z-J. Yu and Yoshiyuki Kawazoe
1228-1236 :
First-Principles Studies on the Structural and Magnetic Properties of 3d/(Cu, Ag, Au) Multilayers
Jian-Tao Wang, Lei Zhou and Yoshiyuki Kawazoe
1237-1243 :
Orbital Correlation Effects in Transition Metal Microclusters
Lei Zhou, Jian-Tao Wang, Dingsheng Wang
and Yoshiyuki Kawazoe
1244-1248 :
Effect of Hydrogen on the Magnetism and Its Solubility in Ferromagnetic Nickel
Jing-Zhi Yu, Qiang Sun, Qian Wang and Yoshiyuki Kawazoe
1249-1254 :
Simulations on Multilayer Relaxations of Aluminum Surfaces
Shigeto R. Nishitani, Sadaichiro Ohgushi, Masato Aoki
and Hirohiko Adachi
1255-1257 :
A Tight-Binding Molecular-Dynamics Study of Copper Clusters
Akito Taneda and Yoshiyuki Kawazoe
1258-1261 :
Thermal Conductivity of Silica Glass at High Temperature by Molecular Dynamics Simulation
Keiichi Takase, Isao Akiyama and Norikazu Ohtori
1262-1268 :
Molecular Dynamics Estimation of Shearing Deformation Properties of α-Silicon Nitride Single Crystal
Shigenobu Ogata, Hiroshi Kitagawa, Naoto Hirosaki
and Hiroaki Yasumoto
1269-1273 :
Molecular Dynamics Analysis of Nucleation and Growth in a Structural Transformation
Takehiko Makino, Yumiko Sato, Kazuki Itoigawa
and Shoichi Matsuda
1274-1280 :
Molecular Dynamics Simulation of Hydrogen-Induced Amorphization: Softening Effect by Incorporation of Hydrogen
Masahiko Katagiri and Hidehiro Onodera
1281-1287 :
Molecular Dynamics Simulation on Deformation Dynamics of Ni and Ni3Al Single Crystals and Ni/Ni3Al Composite Crystal
Tomoyasu Aihara and Tomoyoshi Sho
1288-1294 :
Transient Ordered Phases in a Two-Dimensional Ternary System
Jun Ni and Binglin Gu
1295-1300 :
Effect of Lattice Coherency on Solution Energies of Impurities: Stability of an Epitaxial InAs Monolayer Deposited on GaAs
S. Vannarat, Marcel H. F. Sluiter and Yoshiyuki Kawazoe
1301-1305 :
Prediction of the Effect of Ti on the (111) and (100) Antiphase Boundary Energy in Ni3Al
Hai-Ping Wang, Marcel Sluiter and Yoshiyuki Kawazoe
1306-1313 :
FCC-BCC Phase Transition in Iron under a Periodic Boundary Condition
Masato Shimono, Hidehiro Onodera and Tetsuro Suzuki
1314-1318 :
Site-Percolation Models Including Heterogeneous Particles on a Square Lattice
Ryoji Sahara, Hiroshi Mizuseki, Kaoru Ohno and Yoshiyuki Kawazoe
1319-1322 :
Multi-Valued Magnetic Recording Materials Predicted by Self-Organized Magnetization Dynamics
Masahito Ishihara, Hiroshi Mizuseki, Kaoru Ohno and Yoshiyuki Kawazoe
1323-1330 :
CVD Process Simulation for TiN, Mo Film Growth Rate Distributions
Noboru Yoshikawa, Atsushi Kikuchi and Shoji Taniguchi
1331-1336 :
Marangoni Convection in Half-Zone Liquid Bridge
Zhong Zeng, Hiroshi Mizuseki, Kyoko Ichinoseki,
Kazuyuki Higashino and Yoshiyuki Kawazoe
1337-1341 :
Simulation of Crystal Growth in Solution by Hybrid Modeling
Hiroshi Mizuseki and Yoshiyuki Kawazoe

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