Computer aided innovation of new materials : proceedings of the first International Conference and Exhibition on Computer Applications to Materials Science and Engineering, CAMSE '90, Sunshine City, Ikebukuro, Tokyo, Japan, August 28-31, 1990

Content: Inside Front Cover, Page ii Front Matter, Page iii Copyright, Page iv PREFACE, Page v, Masao Doyama, Tomoo Suzuki, Junji Kihara, Ryoichi Yamamoto INTERNATIONAL ADVISORY COMMITTEE, Page vii EXECUTIVE COMMITTEE, Page viii CO-SPONSORS, Page ix METADATA FOR MATERIALS SCIENCE AND ENGINEERING, Pages 3-8, J.H. Westbrook DATA MODELS AND DICTIONARIES FOR MATERIALS INFORMATION, Pages 9-12, Philip Sargent EC ACTIVITIES ON MATERIALS DATA SYSTEMS, Pages 13-18, H. KROECKEL, N. SWINDELLS ONLINE ACCESS TO WORLDWIDE SOURCES OF MATERIAL PERFORMANCE DATA, Pages 19-23, J.G. Kaufman OBJECTIVE AND CONCEPTUAL DESIGN OF DATA-FREE-WAY SYSTEM (DISTRIBUTED DATA BASE FOR ADVANCED NUCLEAR MATERIALS), Pages 25-28, Mitsutane FUJITA, Hajime NAKAJIMA, Shigeo NOMURA, Shuichi IWATA SPECIFICATIONS OF ‘SERIOUS’ MATERIALS DATA SYSTEMS FOR MATERIALS DESIGN, Pages 29-33, Shuichi IWATA APPLICATION OF ARTIFICIAL INTELLIGENCE FOR MATERIAL DESIGN, Pages 35-42, Setsuo OHSUGA ACCELERATED LEARNING NEURAL NETWORK FOR MATERIAL PROCESSING SENSOR DATA ANALYSIS, Pages 43-48, Xiaoshu XU, Alan ROCK, Jerry E. JONES STRUCTURE-ACTIVITY RELATIONSHIP STUDY OF THE QUINOLONE ANTIBACTERIALS BY THE NEURAL NETWORKS, Pages 49-51, Kohtaro Yuta SELF ORGANIZING INFORMATION SYSTEMS FOR MATERIAL DESIGN, Pages 53-57, Yuzuru Fujiwara, Jihong He, Gyoto Chang, Nobuo Ohbo, Hiroyuki Kitagawa, Kazunori Yamaguchi ACHILLES - AN EXPERT SYSTEM ON CORROSION AND CORROSION CONTROL, Pages 59-63, Peter BALKWILL A PC-BASED PROTOTYPE EXPERT SYSTEM FOR DATA MANAGEMENT AND ANALYSIS OF CREEP AND FATIGUE OF SELECTED MATERIALS AT ELEVATED TEMPERATURES, Pages 65-68, Jeffrey T. FONG, Barry BERNSTEIN AI UTILIZATION FOR AUTOMATED STRUCTURAL DESIGN, Pages 69-74, Genki YAGAWA, Shinobu YOSHIMURA, Yoshihiko MOCHIZUKI IDENTIFICATION OF PROCESS PARAMETERS IN METAL WORKING BY COMPUTATIONAL INVERSE ANALYSIS, Pages 75-80, Junji KIHARA INTELLIGENT DESIGN OF ALUMINIUM ALLOYS, Pages 81-84, Seizo TAKAGI, Shuichi IWATA COMETA: INFORMATIVE SYSTEM ON COMPONENTS AND MATERIALS, Pages 85-88, A.G. Gandini, M.L. Bargellini, F. Fontana, B. Lo Tenero, E. Ponzelli DATA EVALUATION MODELING IN MATERIALS STRENGTH DATABASES, Pages 89-92, Yoshio MONMA, Kenji KANAZAWA, Masao SAKAMOTO, Satoshi NISHIJIMA STANDARD FOR STRENGTH OF MATERIALS AND STRUCTURAL MATERIAL DATABASE SYSTEM FOR LMFBR COMPONENTS, Pages 93-96, Kazumi AOTO, Yusaku WADA CREEP DATA PROCESSING AND TEST MANAGING SYSTEM, Pages 97-100, Yasuhiro MOTOFUJI, Akihiro MATSUZAKI, Osamu WATANABE, Yutaka OKA SIMULATION OF MICROSCOPIC IMAGES BY A DESKTOP IMAGING SYSTEM, Pages 101-104, Kiichi FUKUI, Yasuko KAMISUGI DEVELOPMENT OF CRYSTRUCT, THE CRYSTAL STRUCTURE DESIGN SUPPORTING SYSTEM, Pages 105-108, Hiroshi Hayakawa, Shuitiro Ono, Kazutoshi Tanabe, Kimitoshi Naito, Yutaka Imasato, Fujio Izumi INTEGRATED MATERIAL DESIGN SYSTEM FOR NEW GLASSES, Pages 109-112, Akira Takada, Kazuko Adachi, Misae Keitora, Fujiko Mitsuhashi, Toshiyasu Kawaguchi EFFECTIVE USE OF STRUCTURE-BASED DATABASE MANAGEMENT SYSTEMS IN THE DESIGN AND DEVELOPMENT OF NEW CHEMICAL COMPOUNDS, Pages 113-118, Guenter GRETHE A PARSING SYSTEM OF DIRECTLY INPUT CHEMICAL EQUATION USING APL2 DATA STRUCTURE APPLIED TO THERMOCHEMICAL CALCULATIONS, Pages 119-122, Toshio NISHIKAWA COMPUTATIONAL ATOM MODEL FOR MATERIALS ENGINEERS, Pages 123-125, Toshiro ARATANI AN EXPERIMENTAL OPTIMIZATION TECHNIQUE – NAIS SYSTEM WITH AN INTERPOLATION FUNCTION, Pages 127-130, Yasushi Ikai, Hisaki Miyamoto, Satoshi Asano, Hisami Kimura THE REAL-NUMBER-DISTRIBUTION METHOD AND ITS APPLICATION, Pages 131-134, Shuji Obata THE IMAGE-BASED DATABASE ON ELECTRONIC MATERIALS USING CD-ROM, Pages 135-139, Masato Yamazaki, Masaya Yabe, Yuzuru Fujiwara COMPUTATIONAL/THEORETICAL APPROACH TO THE DESIGN OF NEW MATERIALS, Pages 143-154, A.J. Freeman, S.P. Tang, A. Continenza, C. Li CALCULATIONS OF MATERIALS PROPERTIES USING ab initio ELECTRONIC STRUCTURE METHODS, Pages 155-160, BARRY M. KLEIN LARGE-SCALE NUMERICAL SIMULATIONS AS TOOL IN MOLECULAR AND MATERIALS DESIGN, Pages 161-167, E. Wimmer, R.A. Eades ELECTRONIC STRUCTURE CALCULATIONS FOR MATERIALS DESIGN, Pages 169-174, Taizo SASAKI, Tamio OGUCHI, H. KATAYAMA-YOSHIDA EFFECTIVE POTENTIAL METHOD FOR ELECTRONIC STRUCTURE CALCULATIONS IN MATERIALS DESIGN, Pages 175-180, Shuhei OHNISHI, Takashi IKEDA, Noriko WATARI LOCAL DENSITY APPROXIMATION CALCULATIONS FOR MAGNETIC MULTILAYERS, POINT DEFECTS IN SILICON AND SILICON SURFACES, Pages 181-186, P.J. KELLY DV–Xα CALCULATION OF MULTIPLET ENERGY OF TRANSITION–METAL COMPLEX, Pages 187-192, Xia Shangda PSEUDOPOTENTIAL METHOD FOR TRANSITION METALS: Application of Elasticity in Cu, Ag, and Au, Pages 193-196, Yasuyuki Suzuki, Masahiko Hirata, Masafumi Senoo MAGNETIC-BREAKDOWN OSCILLATIONS AND ENERGY GAP NEAR THE W–POINT IN ALUMINIUM, Pages 197-200, Hiroki HOSODA, Yoshitake UEDA, Takao KINO CALCULATION OF POSITRON DISTRIBUTION AND LIFETIME IN THE OXIDE SUPERCONDUCTORS, Pages 201-204, Shoji ISHIBASHI, Ryoichi YAMAMOTO, Masao DOYAMA VORTEX DYNAMICS OF TWO–DIMENSIONAL XY–MAGNET, Pages 205-208, Chikao KAWABATA, Masaki TAKEUCHI, Alan R. BISHOP THE MODELLING OF INTERFACIAL PHENOMENA, Pages 209-213, A. Marshall STONEHAM AN AB INITIO MOLECULAR-DYNAMICS STUDY OF THE RECONSTRUCTED Si(100) SURFACE, Pages 215-218, Sigeo IHARA, Shi Lun HO, Tsuyoshi UDA, Masahiko HIRAO THEORETICAL STUDY ON BAND-GAP CHARACTER OF (Si)m/(Ge)n STRAINED SUPERLATTICES, Pages 219-224, Minoru IKEDA, Kiyoyuki TERAKURA, Tamio OGUCHI ELECTRONIC STRUCTURE CALCULATIONS OF METAL/ALUMINA INTERFACES, Pages 225-228, Masanori KOHYAMA, Saburo KOSE, Makoto KINOSHITA, Ryoichi YAMAMOTO A DV–Xα STUDY OF OPTICAL PROPERTIES OF THE LAYERED SEMICONDUCTOR COMPOUND MnPS3, Pages 229-231, Yang Jinlong, Xia shangda, Wang Kelin COMPUTER SIMULATION OF MAGNETO-OPTICAL KERR EFFECT OF MULTILAYERED FILMS, Pages 233-236, We-Hyo SOE, Akira YAMAGUCHI, Ryoichi YAMAMOTO CALCULATION OF KERR ROTATION ANGLE AND REFLECTIVITY FOR MAGNETO-OPTICAL MEMORY DISK, Pages 237-239, Yoshinori MAENO, Kayoko OISHI, Haruki YAMANE, Masanobu KOBAYASHI FINITE-TEMPERATURE THEORY OF MAGNETISM IN AMORPHOUS METALS AND ALLOYS, Pages 241-244, Yoshiro KAKEHASHI THE MOST LOCALIZED LINEAR MUFFIN-TIN ORBITAL STUDY FOR ELECTRONIC STRUCTURES OF AMORPHOUS METALS, Pages 245-247, M. Aoki, S. Ohnishi, H. Odaka, K. Tsumuraya AN AB INITIO APPROACH TO MOLECULAR MAGNETOCHEMISTY, Pages 249-253, Kizashi YAMAGUCHI, Mitsutaka OKUMURA, Takayuki FUENO COMPUTATIONAL ANALYSIS OF Si-O COMPLEX IN SILICON CRYSTAL BY MOLECULAR ORBITAL METHOD, Pages 255-258, Atsushi NOGAMI, Tooru MATSUMIYA, William A. GODDARD III A CLASSIFICATION OF THE THIRD-ORDER ORGANIC NONLINEAR OPTICAL SYSTEMS AND PROPOSAL OF NEW-TYPE SYSTEMS, Pages 259-262, Masayoshi NAKANO, Kizashi YAMAGUCHI, Takayuki FUENO AB INITIO MOLECULAR ORBITAL CALCULATIONS OF THIRD-ORDER HYPERPOLARIZABILITIES OF ORGANIC MOLECULES, Pages 263-266, Koji OHTA, Toshio FUKUMI, Toru SAKAGUCHI RECENT PROGRESS IN ELECTRONIC STRUCTURE CALCULATIONS FOR DEFECTS IN METALS, Pages 269-274, R. Zeller, B. Drittler, P.H. Dederichs, U. Klemradt, M. Weinert KROECKEL DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS STUDY ON DEFECTS IN ALUMINUM, Pages 275-278, Tamio OGUCHI, Taizo SASAKI CALCULATION OF ELECTRONIC STATE OF DISLOCATIONS IN COVALENT SEMICONDUCTORS: EFFECT OF CORE RECONSTRUCTION AND SOLITON, Pages 279-283, Kinichi MASUDA-JINDO DAMPING CONSTANTS OF MOVING DISLOCATIONS IN ALUMINIUM AND COPPER CRYSTALS, Pages 285-288, Yoshiko H. OHASHI, Kazutoshi OHASHI, Mitsuru FUKUCHI THEORETICAL ANALYSIS OF THE DAMPING CONSTANT OF VIBRATING DISLOCATION IN ALKALI HALIDES, Pages 289-292, Kazutoshi OHASHI, Yoshiko H. OHASHI, Mitsuru FUKUCHI TIGHT-BINDING APPROACHES TO GRAIN BOUNDARIES IN SEMICONDUCTORS AND CERAMICS, Pages 293-298, Masanori KOHYAMA, Ryoichi YAMAMOTO TIGHT-BINDING CALCULATION OF ATOMIC AND ELECTRONIC STRUCTURE OF TILT GRAIN BOUNDARIES IN SI, Pages 299-304, Yoichi WATANABE, Masanori KOHYAMA, Ryoichi YAMAMOTO AN ATOMISTIC AND ELECTRONIC STUDY OF GRAIN BOUNDARY EMBRITTLEMENT FOR METAL COPPER INDUCED BY BISMUTH SEGREGATION, Pages 305-310, Xi-jun WU, Ba-yi PENG, Fu-xin ZHOU, Qing-qi ZHENG, Qi-heng TANG THEORETICAL STUDY ON THE BENDING OF COMMON (111) PLANE AT INCOHERENT TWIN BOUNDARY IN AUSTENITIC STAINLESS STEEL, Pages 311-314, M. MORI, K. MASUDA-JINDO, K. TANAKA, Y. ISHIDA INTERACTION ENERGY BETWEEN IMPURITIES AND GRAIN BOUNDARIES IN IRON, Pages 315-318, R. YAMAMOTO, K. MASUDA-JINDO PHYSICAL CONSTANTS OF SMALL VACANCY CLUSTERS IN PURE CU, AG AND AU CALCULATED BY THE EMBEDDED ATOM METHOD, Pages 319-322, Yoshiharu SHIMOMURA, Rieko NISHIGUCHI, Hidefumi NAGATA, Tomas Diaz DE LA RUBIA, Michael W. GUINAN COMPUTER SIMULATION OF VOID SWELLING IN METALS AND ALLOYS, Pages 323-326, Eiichi KURAMOTO BINARY COLLISION “MARLOWE” CODE SIMULATION OF THE POINT DEFECT STRUCTURE OF DISPLACEMENT DAMAGE CASCADES IN NEUTRON-IRRADIATED CU AND NI, Pages 327-330, Yoshiharu SHIMOMURA, Nishio WATANABE, Rieko NISHIGUCHI COMPUTER DESIGNING OF EXPERIMENTS APPROPRIATE FOR THE STUDY OF MATERIALS DAMAGING IN FUTURE FUSION REACTOR IRRADIATION ENVIRONMENTS, Pages 331-334, Rieko NISHIGUCHI, Yoshiharu SHIMOMURA, Peter A. HAHN, Michael W. GUINAN, Michio KIRITANI A COMPUTER SIMULATION OF CRACK EXTENSION IN β-SiC, Pages 335-338, Akitaka Sawamura, Yoichi Watanabe, Ryoichi Yamamoto MOLECULAR DYNAMICS SIMULATIONS IN CONDENSED MATTER PHYSICS, Pages 341-346, Shuichi NOSÉ MOLECULAR DYNAMICS SIMULATION OF SOME MOLTEN SALTS–RELATION BETWEEN ELECTRIC CONDUCTIVITY AND SELF-EXCHANGE VELOCITY, Pages 347-352, Isao OKADA STATISTICAL GEOMETRY OF THE SHORT-RANGE ORDER IN MONATOMIC AMORPHOUS SYSTEMS, Pages 353-358, Minoru TANAKA COMPUTER SIMULATION OF RADIATION DAMAGE IN AMORPHOUS SOLIDS, Pages 359-364, Risto M. Nieminen STRUCTURAL FLUCTUATIONS IN ARGON MICROCLUSTERS, Pages 365-370, H. Matsuola, T. Hirokawa, T. Uchida, M. Matsui, M. Doyama STRUCTURAL FLUCTUATIONS IN GOLD MICROCLUSTERS, Pages 371-374, T. Uchida, H. Matsuoka, H. Matsui, M. Doyama AN ATTEMPT TO SIMULATE THE CLUSTER DEPOSITION PROCESS, Pages 375-377, Yasushi SASAJIMA, Toshio SAKUTA, Satoru OZAWA, Ryoichi YAMAMOTO MOLECULAR-DYNAMICS SIMULATIONS FOR LOW ENERGY ION BEAM THIN FILM FORMATION PROCESS AT DIFFERENT INCIDENT BEAM ENERGY AND SUBSTRATE TEMPERATURE, Pages 379-380, Takashi KAWAKUBO NEW CRYSTAL STRUCTURES OF SiO2 PREDICTED BY MOLECULAR DYNAMICS STUDY, Pages 381-384, Shinji Tsuneyuki, Hideo Aoki, Yoshito Matsui MOLECULAR DYNAMICS SIMULATION OF MIXED ALKALI HALIDE GLASS, Pages 385-388, Kenichi KINUGAWA, Kohei KADONO, Hiroshi TANAKA NON-EQUILIBRIUM MOLECULAR DYNAMICS SIMULATION OF VISCOSITY OF FLUORIDE GLASS MELT, Pages 389-392, Tetsuji YANO, Masayuki YAMANE, Satoru INOUE MOLECULAR DYNAMICS SIMULATION OF MOLTEN LITHIUM BROMIDE, Pages 393-396, Sumiko ITOH, Takeo MATSUZAWA, Makoto KONAGAI, Kiyoshi TAKAHASHI COMPUTER SIMULATION ON A VACANCY AND DISLOCATIONS IN ORGANIC CRYSTALS, Pages 397-400, Isamu OKADA, Naoki IDE, Kenichi KOJIMA SIMULATIONS FOR DYNAMIC BEHAVIORS OF XYLENES INSIDE THE PORES OF PENTASIL ZEOLITIC CATALYSTS USING FORCE FIELD CALCULATION, Pages 401-404, Yoshiaki NAKAZAKI, Tomoyuki INUI STUDY ON INTERFACIAL STRUCTURE OF Cu-Fe ALLOY USING MOLECULAR DYNAMICS, Pages 405-408, Takashi Arai, Katsuaki Suganuma FAST ALGORITHM FOR COVERING CONFORMATIONAL SPACE BY MOLECULAR MECHANICS, Pages 411-416, Eiji Osawa, Hitoshi Goto COMPUTER AIDED DESIGN OF ARTIFICIAL PROTEINS, Pages 417-422, Haruki NAKAMURA The SPECTRE System As Advanced Tool for Global Experimental Optimization, Pages 423-428, Mario Marsili, Mototsugu Yoshida, Yasuo Kikuzono, Hiroyuki Katsumi SPECINFO - A MULTIDIMENSIONAL INTERPRETATION SYSTEM, Pages 429-432, Reinhard NEUDERT AUTOMATIC RECOGNITION OF COMMON STRUCTURAL FEATURES AMONG CHEMICAL COMPOUNDS USING REDUCED STRUCTURE REPRESENTATION BASED ON FUNCTIONAL GROUPS, Pages 433-438, Yoshimasa TAKAHASHI, Masayuki SUKEKAWA, Shin-ichi SASAKI COMPUTER APPLICATIONS IN PROTEIN ENGINEERING, Pages 439-442, Toru YAO A DYNAMIC AND STEREOGRAPHIC VISUALIZATION OF A MOLECULE BY THE TECHNIQUES OF MOLECULAR DYNAMICS SIMULATIONS, COMPUTER GRAPHICS, AND MULTIPLEX HOLOGRAPHY, Pages 443-446, Sumio Tokita, Atsushi Tomonaga, Keiichiro Ogawa, Takayuki Saito, Yoshitaka Minami, Masane Suzuki, Hiromitsu Imamura, Yoshiya Kogo, Takao Sugiyama, Satoru Toyooka CONFORMATIONAL ANALYSIS OF MIKIMOPINE, Pages 447-450, Kazuhiko Nakamura, Hiroshi Chuman, Akira Isogai, Naoyuki Fukuchi A RAPID ANALYSIS METHOD OF VARIATIONS IN POLYMER CHAIN ½, Pages 451-454, TOSHIO NAKAO APPLICATIONS OF THE COMPUTER AIDED CHEMISTRY SYSTEM ACACS IN AGRICULTURAL CHEMICAL RESEARCH, Pages 455-460, Yasuyuki KURITA, Chiyozo TAKAYAMA, Toshiyuki KATAGI, Mototsugu YOSHIDA AN OVERVIEW OF CHEMICAL DATABASES, Pages 461-466, David R. Lide PLASTICS MATERIAL DATA BASE filed on a COMPACT DISC (CAPDAS Version 2), Pages 467-470, Shouei FUJISHIGE, Akio SHIMIZU THE POLYMER PROJECT AT BIOSYM TECHNOLOGIES, INC, Pages 471-475, Caibao Qian, J.D. Honeycutt, Stephen J. Mumby, B.E. Eichinger AN ARTIFICIAL INTELLIGENT SYSTEM TO DETECT COMMON FEATURES NECESSARY FOR BIOLOGICAL ACTIVITY : APPLICATION OF ANALOGS FOR ALDOSE REDUCTASE INHIBITORS, Pages 477-480, Tamio YASUKAWA, Katsunori SATOH, Noriaki GOTOH, Toshimasa ISHID, Shigeyuki SUMIYA, Kunihiro KITAMURA MO DESIGN OF FUNCTIONAL DYE MATERIALS, Pages 481-486, Masaru MATSUOKA OPTICAL PERSISTENT HOLE BURNING OF ANTHRAQUINONE DERIVATIVES, Pages 487-490, Yoshihisa KAWAGUCHI MOLECULAR ORBITAL STUDY FOR ELECTRICALLY CONDUCTING POLYTRIPHENYLAMINES, Pages 491-494, Yasuhiko OHSAWA, Hidekazu TAKAHASHI, Yasuyuki MUROFUSHI, Jun-ichi TAKIMOTO THE AUTOMATION OF ORGANIC SYNTHESIS DESIGN: A BEGINNING, Pages 495-498, Mototsugu YOSHIDA, Tetsuhiko TAKABATAKE, Malcolm BERSOHN A QUANTUM CHEMICAL REACTION DESIGN OF A PLASMA CHEMICAL REACTION OF VINYLSILANE, Pages 499-502, Kota SATO, Akihiko UCHIYAMA, Toru ODE, Susumu IWABUCHI, Tsuneo HIRANO, Hideomi KOINUM AB INITIO MO CALCULATION OF THE STRUCTURE AND ENERGY LEVELS OF 7-HYDROXYCOUMARIN AND ITS TAUTOMER, Pages 503-505, Tetsuo MORIYA, Yoshihisa KAWAGUCHI THE STEREOCHEMISTRY OF REDUCTION PRODUCTS OF SANTONIN: EXAMINATION OF CONFORMATIONS BY MM2 CALCULATIONS, Pages 507-510, Jun-ichi Ishiyama, Shin Imaizumi, Akio Karube MOLECULAR MODELING OF ANION SELECTIVE SYNTHETIC LIGANDS BASED ON MOLECULAR MECHANICAL CALCULATIONS EMPLOYING AB INITIO ATOM PAIR POTENTIALS FOR ION-LIGAND INTERACTION ENERGY EVALUATION, Pages 511-514, Takuya MARUIZUMI ELECTROMAGNETIC PHENOMENA IN METALS PROCESSING OPERATIONS, Pages 517-523, Julian SZEKELY THE THEORETICAL ANALYSIS OF A COLD CRUCIBLE, Pages 525-530, Kazuhiko Iwai, Mamoru Kuwabara, Kensuke Sassa, Shigeo Asai MATHEMATICAL MODELING OF MICROWAVE-ASSISTED CHEMICAL VAPOR INFILTRATION FOR THE PRODUCTION OF CERAMIC–CERAMIC COMPOSITES, Pages 531-536, J.W. EVANS, D. GUPTA Electromagnetic Analysis on Cold Crucible for Levitation, Pages 537-540, Takehiko TOH, Marcel GARNIER EFFECT OF ELECTROMAGNETIC PRESSURE ON EARLY SOLIDIFICATION IN A CONTINUOUS CASTING, Pages 541-544, Jun-ichi Sakane, Keiji Tsunenari, Eiichi Takeuchi, Ikuto Miyoshino DEVELOPMENT OF TWO-DIMENSIONAL BLAST FURNACE TOTAL MODEL AND IT'S APPLICATION, Pages 545-548, Takashi SUGIYAMA, Masayasu SUGATA DEVELOPMENT OF A MATHEMATICAL MODEL FOR BURDEN DISTRIBUTION IN A BLAST FURNACE, Pages 549-552, Shinroku MATSUZAKI, Takashi SUGIYAMA, Yoshio OKUNO EFFECTS OF MAGNETIC FIELD ON FLUID FLOW OF SILICON MELT IN CZOCHRALSKI PROCESS, Pages 553-556, Kensuke OKAZAWA, Ikuo SAWADA, Masahiro TANAKA NUMERICAL SIMULATIONS OF FORCED AND NATURAL CONVECTIONS BY THE USE OF NEW CFD ALGORITHM NSMAC, Pages 557-560, Ikuo Sawada, Hidenori Harada THERMAL HISTORY ANALYSIS OF A CZ CRYSTAL WITH LARGE DIAMETER, Pages 561-564, S. MIYAHARA, S. KOBAYASHI, T. FUJIWARA, T. KUBO, H. FUJIWARA COMPUTER SIMULATION IN INJECTION MOLDING OF THERMOPLASTICS, Pages 565-568, Takaaki MATSUOKA, Jun-ichi TAKABATAKE, Akihiko KOIWAI, Yoshinori INOUE, Satoru YAMAMOTO, Hideroh TAKAHASHI SIMULATION FOR POLYMER MELT FLOW IN INJECTION MOLDING, Pages 569-572, Katsuhiko SAGAE, Makoto KOIZUMI, Masanori YAMAKAWA INJECTION MOLDING POLYMER FLOW SIMULATION BY THE FINITE ELEMENT METHOD, Pages 573-576, Akira MIZUKAMI NUMERICAL SIMULATION OF FLOAT GLASS FORMING PROCESS, Pages 577-579, Motoichi IGA, Hiroshi MASE COMPUTER SIMULATION OF SOLIDIFICATION AND ITS APPLICATION TO MATERIALS DEVELOPMENT, Pages 581-585, Itsuo OHNAKA DEVELOPMENT OF A SIMULATOR OF SOLIDIFICATION PATH AND FORMATION OF NONMETALLIC INCLUSIONS DURING SOLIDIFICATION OF STAINLESS STEELS, Pages 587-590, Wataru YAMADA, Tooru MATSUMIYA, Bo SUNDMAN SOLIDIFICATION ANALYSIS OF CRYSTAL GROWTH IN OHNO CONTINUOUS CASTING PROCESS, Pages 591-596, J.C. Liu, J.D. Hwang, K.C. Su CONTACT DESCRIPTIONS IN FINITE ELEMENT SIMULATION OF METAL FORMING PROCESSES, Pages 597-602, Akitake MAKINOUCHI FINITE ELEMENT CONTROL AND MANAGEMENT FOR METAL FORMING PROCESS SIMULATION, Pages 603-608, Tatsuhiko AIZAWA SIMULATIONS OF SHOCK RECOVERY FIXTURES FOR CONDENSED MATTER UNDER HIGH PRESSURES, Pages 609-614, K. TANAKA ATOMISTIC THEORY OF FRACTURE OF BRITTLE MATERIALS, Pages 615-620, K. MASUDA-JINDO, V.K. TEWARY, R. THOMSON Application of Adaptive Remeshing Method to Simulation of Material Forming Processes, Pages 621-624, Nobuki Yukawa, Noboru Kikuchi FINITE ELEMENT CREEP DAMAGE ANALYSIS OF PIPING, Pages 625-628, Noriyuki MIYAZAKI, Yuuichiro AIHARA, Seiya HAGIHARA, Tsuyoshi MUNAKATA A NUMERICAL ANALYSIS OF IMPULSIVE STRESS IN A GLASS PLATE USING THE FINITE ELEMENT METHOD, Pages 629-632, Hidemi KATOH, Kozo NOMOTO PLASTIC DAMAGE MODELING OF ANISOTROPIC SHEET STEEL FORMING, Pages 633-636, Y.L. Kang, X.J. Wang, J. Kihara, T. Aizawa MATHEMATICAL MODEL FOR PREDICTING MICROSTRUCTURE AND STRENGTH OF HOT ROLLED STEELS, Pages 637-640, Takehide SENUMA, Masayoshi SUEHIRO, Hiroshi YADA, Satoshi AKAMATSU, Kazuaki SATO DEVELOPMENT OF A METALLURGICAL MODEL FOR THE PREDICTION OF PEARLITE TRANSFORMATION AND ITS APPLICATION TO HIGH-CARBON SHEET STEEL PRODUCTION, Pages 641-644, Nozomi KOMATSUBARA, Kazutoshi KUNISHIGE FINITE ELEMENT SIMULATION OF THREE-DIMENSIONAL DEFORMATION IN PUNCH STRETCHING OF SHEET METALS, Pages 645-648, Ken-ichiro MORI, Tatsuji KAWAGUCHI, Katsuhiko YAMAGUCHI DEVELOPMENT OF A SHAPE MODEL FOR QUALITATIVE ANALYSIS, Pages 649-652, Shuichi FUKUDA PREDICTION OF SECONDARY RECRYSTALLIZATION TEXTURE BY COMPUTER SIMULATION, Pages 653-656, J. Harase, R. Shimizu, Y. Nakamura, N. Takahashi A MATHEMATICAL MODEL FOR PHASE TRANSFORMATION PLASTICITY USING FINITE ELEMENT METHOD, Pages 657-660, Hiroshi Shigefuji, Toshihiko Ariyoshi PROCESS SIMULATIONS OF HIP AND CIP, Pages 661-666, Tomokazu NAKAGAWA, Akira NOHARA A FINITE ELEMENT ANALYSIS OF ELECTROMAGNETIC FORMING FOR TUBE EXPANSION, Pages 667-672, Sung Ho LEE, Dong Nyung LEE THEORETICAL STUDIES OF SILICON CRYSTAL GROWTH MECHANISM BY AB INITIO MOLECULAR ORBITAL CALCULATIONS, Pages 675-679, Yoshio Ohshita, Toshikazu Takada, Akihiko Ishitani SURFACE ENERGIES AND ORDER-STATE: EFFECTS ON SEMICONDUCTOR GROWTH, Pages 681-686, Srinivasan KRISHNAMURTHY, M.A. BERDING, A. SHER, A.-B. CHEN MOLECULAR DYNAMICS SIMULATIONS OF MOLECULAR BEAM EPITAXY, Pages 687-692, G.H. Gilmer, A.F. Bakker MOLECULAR-DYNAMICS SIMULATION OF MOLECULAR-BEAM-EPITAXY USING LENNARD-JONES AND EMPIRICAL Si POTENTIALS, Pages 693-698, Itsuo UMEBU, Minoru IKEDA, Takahiro YAMASAKI, Kumiko FURUYA, Kiyoyuki TERAKURA ATOMIC–SCALE CALCULATIONS AND SIMULATIONS FOR MATERIALS SYNTHESIS AND DESIGN, Pages 699-704, D.D. VVEDENSKY, S. CLARKE, S. CRAMPIN DYNAMICAL DIFFRACTION CALCULATIONS FOR RHEED INTENSITY OSCILLATIONS DURING MBE GROWTH, Pages 705-710, L.-M. Peng, M.J. Whelan COMPUTER SIMULATION OF STRAIN RELAXATION MECHANISM OF MBE GROWN LATTICE MISMATCHED InGaAs/GaAs LAYERS, Pages 711-714, Masao Tabuchi, Susumu Noda, Akio Sasaki AN OBJECT ORIENTED DATA BASE SYSTEM FOR DESIGN OF SEMICONDUCTOR MATERIALS AND DEVICES, Pages 715-718, Hachiro IJUIN, Shun-ichi GONDA BAND OFFSET OF AIGalnAsSb ALLOY SEMICONDUCTOR, Pages 719-722, Tadaaki Kaneko, Shun-ichi Gonda, Hajime Asahi Simulation of ULSI Processes and Devices, Pages 723-728, Hans KOSINA, Karl WIMMER, Claus FISCHER, Siegfried SELBERHERR Multi-Dimensional Numerical Modeling for Thermal Oxidation of Silicon, Pages 729-734, Hiroyuki UMIMOTO, Shinji ODANAKA SIMULATION OF THREE-DIMENSIONAL NEGATIVE PHOTORESIST IMAGES USING PHASE-SHIFTING MASK, Pages 735-739, Tatsumi ISHIZUKA VLSI PROCESS SIMULATION AND ITS APPLICATION TO BIPOLAR DEVICE FABRICATION, Pages 741-744, Kenji Nishi, Shigeki Kuroda, Nobuyoshi Shimizu, Yoshihisa Okita MONTE CARLO SIMULATION OF IONIZATION PHENOMENA IN Si-MOSFET'S, Pages 745-748, Nobuyuki SANO, Masaaki TOMIZAWA, Akira YOSHII MONTE CARLO SIMULATION FOR VELOCITY OVERSHOOT EFFECTS IN HETEROJUNCTION BIPOLAR TRANSISTORS, Pages 749-752, Masaaki TOMIZAWA, Hideaki TANIYAMA, Tomofumi FURUTA, Akira YOSHII ENSEMBLE MONTE CARLO SIMULATION OF SUBMICRON GaAs TRANSISTORS INCLUDING PAULI EXCLUSION PRINCIPLE, Pages 753-756, Yoshinori YAMADA, Yoshiaki MATSUGUMA, Toshimitsu KOURA TWO–DIMENSIONAL SIMULATOR OF GaAlAs/GaAs AND InGaAsP/InP HETEROSTRUCTURE LASERS, Pages 757-761, Tsukuru OHTOSHI, Ken YAMAGUCHI SIMULATION OF CURRENT DENSITY AND TEMPERATURE AROUND DEFECTS IN ZnO VARISTOR MATERIALS, Pages 763-766, Naohito Yamada, Takao Soma MODELS FOR THE MATHEMATICAL MODELING OF THE PERFORMANCE OF ZnO VARISTOR, Pages 767-769, CAO, ZE-CHUN, SONG, RUN-SHENG CALPHAD ANALYSIS OF MATERIALS PROCESSING AND PERFORMANCE, Pages 773-778, Larry Kaufman AN ATTEMPT OF FIRST PRINCIPLE CALCULATION OF ALLOY PHASE DIAGRAM, Pages 779-784, Tooru MATSUMIYA, Hideaki SAWADA, Wataru YAMADA, Atsushi NOGAMI COMPUTER MODELING OF PHASE STABILITIES, Pages 785-790, T.B. Massalski, H. Baxi, S. Pei, S. Noguchi PHASE STABILITY AND DIAGRAMS: A CASE STUDY IN COMPUTATIONAL MATERIALS ENGINEERING, Pages 791-794, J.M. SANCHEZ, J.D. BECKER, A.E. CARLSSON THERMO-CALC, A GENERAL TOOL FOR PHASE DIAGRAM CALCULATIONS, Pages 795-798, Bo Sundman A PSEUDOPOTENTIAL APPROACH TO SYSTEMATIC INVESTIGATION OF MIXING ENTHALPIES FOR SEMICONDUCTOR ALLOY SYSTEMS, Pages 799-802, Tomonori ITO ALLOY DESIGN BASED ON MOLECULAR ORBITAL METHOD, Pages 803-808, Masahiko MORINAGA, Natsuo YUKAWA MONTE CARLO SIMULATION OF MICROSTRUCTURAL EVOLUTION IN STEEL, Pages 809-814, Yoshiyuki Saito, Masato Enomoto COMPUTATIONAL MODEL FOR PREDICTING MICROSTRUCTURES AND MECHANICAL PROPERTIES IN MANUFACTURING OF HEAVY STEEL PLATES, Pages 815-818, Atsuhiko YOSHIE, Masa-aki FUJIOKA, Yasumitsu ONOE, Kiyoshi NISHIOKA COMPUTER SIMULATION OF MICROSTRUCTURAL CHANGES IN THERMOMECHANICAL PROCESSING OF 18Cr-8Ni AND 9Cr-1Mo-V-Nb STEELS, Pages 819-822, Yoshiyuki SAITO, Akihiro MATSUZAKI, Chiaki SHIGA SPINODAL DECOMPOSITION SIMULATION OF α′ PHASE IN FERRITIC STAINLESS STEELS, Pages 823-826, Akihiko HIRANO, Norimasa CHIBA, Yuichi ISHIKAWA EXPLORATORY STUDY ON PROVIDING AUSTENITIC STAINLESS STEELS DESIGNED FOR NUCLEAR APPLICATIONS, Pages 827-830, Hajime NAKAJIMA, Susumu ISOBE, Katsutoshi WATANABE, Tatsuo KONDO NICKEL-BASE SINGLE CRYSTAL SUPERALLOYS DESIGNED BY A d-ELECTRONS CONCEPT, Pages 831-834, Kazuhiro MATSUGI, Yoshinori MURATA, Masahiko MORINAGA, Natsuo YUKAWA THERMODYNAMICS AIDED DESIGN OF α+α 2HIGH TEMPERATURE TITANIUM ALLOYS, Pages 835-838, Hidehiro ONODERA, Sizuo NAKAZAWA, Katsumi OHNO, Toshihiro YAMAGATA, Michio YAMAZAKI THEORETICAL STUDY ON ENHANCED DUCTILITY OF MO-RE ALLOYS, Pages 839-842, K. MASUDA-JINDO, S. TAKEUCHI COMPUTER SIMULATION OF THE INTERFACIAL ENERGY BETWEEN BCC/FCC INTERFACES, Pages 843-846, Yoshihiko GOTOH, Hiroshi FUKUDA COMPUTER SIMULATION OF HIGH-RESOLUTION ELECTRON MICROSCOPE IMAGES OF LAMELLAR BOUNDARIES IN TiAl, Pages 847-852, Haruyuki INUI, Atusi NAKAMURA, Myung-Hoon OH, Masaharu YAMAGUCHI KINETICS OF PHASE STABILITY OF INTERMETALLIC COMPOUNDS, Pages 853-856, Tetsuo MOHRI, Yasutaka SUGAWARA COMPUTER SIMULATION OF LOCAL ATOMIC DISPLACEMENTS IN DIFFUSE OMEGA PHASE, Pages 857-860, Naohisa TAKESUE, Masahiko MORINAGA, Natsuo YUKAWA, Masato KATO, Ken-ichi OSHIMA, Jimpei HARADA, Satoshi SASAKI, Shuji HANADA REVERSE MONTE CARLO SIMULATION OF AMORPHOUS Pd80Si20 ALLOY, Pages 861-864, Yoshihiro OKAMOTO, Ryuzo TAKAGI MODEL STRUCTURES OF AMORPHOUS ALLOYS DERIVED FROM A MODEL ICOSAHEDRAL PHASE, Pages 865-868, Tetsushoku TEI, Keiichi EDAGAWA, Kaoru KIMURA, Shin TAKEUCHI MODELLING MESOSCOPIC SYSTEMS, Pages 869-872, T.C. CHOY, J.H. HARDING, A.H. HARKER, P.A. MULHERAN, L.W. SMITH, A.M. STONEHAM SOME ASPECTS OF COMPUTER UTILIZATION IN MATERIALS DESIGN DIVISION OF NRIM, Pages 873-878, Ken'ichi Hoshimoto, Michio Yamazaki A PERSONAL COMPUTER DATA BASE FOR METALLIC STRUCTURAL MATERIALS: CODE & STANDARD SECTION, Pages 879-882, Franco CESARI, Arnaldo CHIARINI, Anna Grazia GANDINI DESIGN OF NEW GLASS STRUCTURE AND PROPERTIES BY MOLECULAR DYNAMICS METHOD, Pages 885-890, Kazuyuki HIRAO MATERIALS DESIGN OF GLASS AND DEVELOPMENT OF IMPROVED EXPERT SYSTEM, Pages 891-896, Akio MAKISHIMA, Mamoru MITOMO, Hideki MONMA, Nobuyasu MIZUTANI, Itaru YASUI, Tosirou FUTAGAMI MATERIAL DESIGN OF CERAMICS AND GLASSES – GLASS DATABASE AND CERAMIC DESIGN SYSTEM, Pages 897-902, Itaru YASUI EXPERT SYSTEM FOR THE DEVELOPMENT OF SILICON NITRIDE CERAMICS, Pages 903-906, Mamoru MITOMO, Hideki MONMA, Takayasu IKEGAMI, Akio MAKISHIMA STRUCTURE OF FLUOROPHOSPHATE GLASSES, Pages 907-910, H. Inoue, A. Makishima AN X-RAY DIFFRACTION AND MOLECULAR DYNAMICS INVESTIGATION OF SOME ALKALI FLUOROBERYLLATE GLASSES AND MELTS, Pages 911-914, Norimasa UMESAKI, Hideo OHNO, Nobuya IWAMOTO A MICROSCOPIC CALCULATION OF THERMAL PROPERTIES OF IONIC SOLID SOLUTIONS, Pages 915-918, Shinji NAMBU, Masaki OIJI ORIENTED MOSAIC MODEL CHARACTERIZING HOT-PRESSED Bi2 Te3, Pages 919-922, Hideo WADA, Youichi OKAMOTO, Toru MIYAKAWA, Taizo IRIE PREMAT/POSTMAT : A COMPUTER SOFTWARE FOR COMPUTATIONAL MECHANICS OF COMPOSITE MATERIALS, Pages 925-934, Jose Miranda GUEDES, Noboru KIKUCHI FINITE ELEMENT ANALYSIS OF AN INTERFACE CRACK BETWEEN DISSIMILAR DUCTILE MATERIALS, Pages 935-940, Shigeru AOKI, Kikuo KISHIMOTO, Noriyasu TAKEUCHI SHAPE OPTIMIZATION FOR REDUCING STRESS AT CERAMICS/METAL JOINTS, Pages 941-944, Hidekazu MURAKAWA, Yukio UEDA A DESIGN EXPERT SYSTEM FOR FUNCTIONALLY GRADIENT MATERIALS, Pages 945-950, Tohru Hirano MATHEMATICAL MODELING OF ELECTROMAGNETIC CASTING OF METALS AND SOME EXPERIMENTAL VERIFICATION, Pages 951-956, James W. EVANS, Daniel P. COOK NUMERICAL ANALYSIS OF MASS DIFFUSION AND HEAT CONDUCTION PHENOMENA IN METAL/CARBIDE COMPOSITE BY THERMOMIGRATION, Pages 957-960, Tomoyasu AIHARA, Mikio KAJI, Tadashi IGARASHI MATERIAL DESIGN OF MMC USING FEM, Pages 961-964, Keizo HASHIMOTO, Shouichi SEKIGUCHI, Katsutoshi YAMADA MODELING OF NANOMETER SCALE COMPOSITE STRUCTURES FORMED BY OBLIQUE DEPOSITION OF TWO MATERIALS FROM DIFFERENT DIRECTIONS, Pages 965-968, Yasuhiko TAKEDA, Tomoyoshi MOTOHIRO, Shoji NODA AUTHOR INDEX, Pages 969-973 Subject Index, Pages 975-984 Content: Inside Front Cover, Page ii Front Matter, Page iii Copyright, Page iv PREFACE, Page v, Masao Doyama, Tomoo Suzuki, Junji Kihara, Ryoichi Yamamoto INTERNATIONAL ADVISORY COMMITTEE, Page vii EXECUTIVE COMMITTEE, Page viii CO-SPONSORS, Page ix METADATA FOR MATERIALS SCIENCE AND ENGINEERING, Pages 3-8, J.H. Westbrook DATA MODELS AND DICTIONARIES FOR MATERIALS INFORMATION, Pages 9-12, Philip Sargent EC ACTIVITIES ON MATERIALS DATA SYSTEMS, Pages 13-18, H. KROECKEL, N. SWINDELLS ONLINE ACCESS TO WORLDWIDE SOURCES OF MATERIAL PERFORMANCE DATA, Pages 19-23, J.G. Kaufman OBJECTIVE AND CONCEPTUAL DESIGN OF DATA-FREE-WAY SYSTEM (DISTRIBUTED DATA BASE FOR ADVANCED NUCLEAR MATERIALS), Pages 25-28, Mitsutane FUJITA, Hajime NAKAJIMA, Shigeo NOMURA, Shuichi IWATA SPECIFICATIONS OF ‘SERIOUS’ MATERIALS DATA SYSTEMS FOR MATERIALS DESIGN, Pages 29-33, Shuichi IWATA APPLICATION OF ARTIFICIAL INTELLIGENCE FOR MATERIAL DESIGN, Pages 35-42, Setsuo OHSUGA ACCELERATED LEARNING NEURAL NETWORK FOR MATERIAL PROCESSING SENSOR DATA ANALYSIS, Pages 43-48, Xiaoshu XU, Alan ROCK, Jerry E. JONES STRUCTURE-ACTIVITY RELATIONSHIP STUDY OF THE QUINOLONE ANTIBACTERIALS BY THE NEURAL NETWORKS, Pages 49-51, Kohtaro Yuta SELF ORGANIZING INFORMATION SYSTEMS FOR MATERIAL DESIGN, Pages 53-57, Yuzuru Fujiwara, Jihong He, Gyoto Chang, Nobuo Ohbo, Hiroyuki Kitagawa, Kazunori Yamaguchi ACHILLES - AN EXPERT SYSTEM ON CORROSION AND CORROSION CONTROL, Pages 59-63, Peter BALKWILL A PC-BASED PROTOTYPE EXPERT SYSTEM FOR DATA MANAGEMENT AND ANALYSIS OF CREEP AND FATIGUE OF SELECTED MATERIALS AT ELEVATED TEMPERATURES, Pages 65-68, Jeffrey T. FONG, Barry BERNSTEIN AI UTILIZATION FOR AUTOMATED STRUCTURAL DESIGN, Pages 69-74, Genki YAGAWA, Shinobu YOSHIMURA, Yoshihiko MOCHIZUKI IDENTIFICATION OF PROCESS PARAMETERS IN METAL WORKING BY COMPUTATIONAL INVERSE ANALYSIS, Pages 75-80, Junji KIHARA INTELLIGENT DESIGN OF ALUMINIUM ALLOYS, Pages 81-84, Seizo TAKAGI, Shuichi IWATA COMETA: INFORMATIVE SYSTEM ON COMPONENTS AND MATERIALS, Pages 85-88, A.G. Gandini, M.L. Bargellini, F. Fontana, B. Lo Tenero, E. Ponzelli DATA EVALUATION MODELING IN MATERIALS STRENGTH DATABASES, Pages 89-92, Yoshio MONMA, Kenji KANAZAWA, Masao SAKAMOTO, Satoshi NISHIJIMA STANDARD FOR STRENGTH OF MATERIALS AND STRUCTURAL MATERIAL DATABASE SYSTEM FOR LMFBR COMPONENTS, Pages 93-96, Kazumi AOTO, Yusaku WADA CREEP DATA PROCESSING AND TEST MANAGING SYSTEM, Pages 97-100, Yasuhiro MOTOFUJI, Akihiro MATSUZAKI, Osamu WATANABE, Yutaka OKA SIMULATION OF MICROSCOPIC IMAGES BY A DESKTOP IMAGING SYSTEM, Pages 101-104, Kiichi FUKUI, Yasuko KAMISUGI DEVELOPMENT OF CRYSTRUCT, THE CRYSTAL STRUCTURE DESIGN SUPPORTING SYSTEM, Pages 105-108, Hiroshi Hayakawa, Shuitiro Ono, Kazutoshi Tanabe, Kimitoshi Naito, Yutaka Imasato, Fujio Izumi INTEGRATED MATERIAL DESIGN SYSTEM FOR NEW GLASSES, Pages 109-112, Akira Takada, Kazuko Adachi, Misae Keitora, Fujiko Mitsuhashi, Toshiyasu Kawaguchi EFFECTIVE USE OF STRUCTURE-BASED DATABASE MANAGEMENT SYSTEMS IN THE DESIGN AND DEVELOPMENT OF NEW CHEMICAL COMPOUNDS, Pages 113-118, Guenter GRETHE A PARSING SYSTEM OF DIRECTLY INPUT CHEMICAL EQUATION USING APL2 DATA STRUCTURE APPLIED TO THERMOCHEMICAL CALCULATIONS, Pages 119-122, Toshio NISHIKAWA COMPUTATIONAL ATOM MODEL FOR MATERIALS ENGINEERS, Pages 123-125, Toshiro ARATANI AN EXPERIMENTAL OPTIMIZATION TECHNIQUE – NAIS SYSTEM WITH AN INTERPOLATION FUNCTION, Pages 127-130, Yasushi Ikai, Hisaki Miyamoto, Satoshi Asano, Hisami Kimura THE REAL-NUMBER-DISTRIBUTION METHOD AND ITS APPLICATION, Pages 131-134, Shuji Obata THE IMAGE-BASED DATABASE ON ELECTRONIC MATERIALS USING CD-ROM, Pages 135-139, Masato Yamazaki, Masaya Yabe, Yuzuru Fujiwara COMPUTATIONAL/THEORETICAL APPROACH TO THE DESIGN OF NEW MATERIALS, Pages 143-154, A.J. Freeman, S.P. Tang, A. Continenza, C. Li CALCULATIONS OF MATERIALS PROPERTIES USING ab initio ELECTRONIC STRUCTURE METHODS, Pages 155-160, BARRY M. KLEIN LARGE-SCALE NUMERICAL SIMULATIONS AS TOOL IN MOLECULAR AND MATERIALS DESIGN, Pages 161-167, E. Wimmer, R.A. Eades ELECTRONIC STRUCTURE CALCULATIONS FOR MATERIALS DESIGN, Pages 169-174, Taizo SASAKI, Tamio OGUCHI, H. KATAYAMA-YOSHIDA EFFECTIVE POTENTIAL METHOD FOR ELECTRONIC STRUCTURE CALCULATIONS IN MATERIALS DESIGN, Pages 175-180, Shuhei OHNISHI, Takashi IKEDA, Noriko WATARI LOCAL DENSITY APPROXIMATION CALCULATIONS FOR MAGNETIC MULTILAYERS, POINT DEFECTS IN SILICON AND SILICON SURFACES, Pages 181-186, P.J. KELLY DV–Xα CALCULATION OF MULTIPLET ENERGY OF TRANSITION–METAL COMPLEX, Pages 187-192, Xia Shangda PSEUDOPOTENTIAL METHOD FOR TRANSITION METALS: Application of Elasticity in Cu, Ag, and Au, Pages 193-196, Yasuyuki Suzuki, Masahiko Hirata, Masafumi Senoo MAGNETIC-BREAKDOWN OSCILLATIONS AND ENERGY GAP NEAR THE W–POINT IN ALUMINIUM, Pages 197-200, Hiroki HOSODA, Yoshitake UEDA, Takao KINO CALCULATION OF POSITRON DISTRIBUTION AND LIFETIME IN THE OXIDE SUPERCONDUCTORS, Pages 201-204, Shoji ISHIBASHI, Ryoichi YAMAMOTO, Masao DOYAMA VORTEX DYNAMICS OF TWO–DIMENSIONAL XY–MAGNET, Pages 205-208, Chikao KAWABATA, Masaki TAKEUCHI, Alan R. BISHOP THE MODELLING OF INTERFACIAL PHENOMENA, Pages 209-213, A. Marshall STONEHAM AN AB INITIO MOLECULAR-DYNAMICS STUDY OF THE RECONSTRUCTED Si(100) SURFACE, Pages 215-218, Sigeo IHARA, Shi Lun HO, Tsuyoshi UDA, Masahiko HIRAO THEORETICAL STUDY ON BAND-GAP CHARACTER OF (Si)m/(Ge)n STRAINED SUPERLATTICES, Pages 219-224, Minoru IKEDA, Kiyoyuki TERAKURA, Tamio OGUCHI ELECTRONIC STRUCTURE CALCULATIONS OF METAL/ALUMINA INTERFACES, Pages 225-228, Masanori KOHYAMA, Saburo KOSE, Makoto KINOSHITA, Ryoichi YAMAMOTO A DV–Xα STUDY OF OPTICAL PROPERTIES OF THE LAYERED SEMICONDUCTOR COMPOUND MnPS3, Pages 229-231, Yang Jinlong, Xia shangda, Wang Kelin COMPUTER SIMULATION OF MAGNETO-OPTICAL KERR EFFECT OF MULTILAYERED FILMS, Pages 233-236, We-Hyo SOE, Akira YAMAGUCHI, Ryoichi YAMAMOTO CALCULATION OF KERR ROTATION ANGLE AND REFLECTIVITY FOR MAGNETO-OPTICAL MEMORY DISK, Pages 237-239, Yoshinori MAENO, Kayoko OISHI, Haruki YAMANE, Masanobu KOBAYASHI FINITE-TEMPERATURE THEORY OF MAGNETISM IN AMORPHOUS METALS AND ALLOYS, Pages 241-244, Yoshiro KAKEHASHI THE MOST LOCALIZED LINEAR MUFFIN-TIN ORBITAL STUDY FOR ELECTRONIC STRUCTURES OF AMORPHOUS METALS, Pages 245-247, M. Aoki, S. Ohnishi, H. Odaka, K. Tsumuraya AN AB INITIO APPROACH TO MOLECULAR MAGNETOCHEMISTY, Pages 249-253, Kizashi YAMAGUCHI, Mitsutaka OKUMURA, Takayuki FUENO COMPUTATIONAL ANALYSIS OF Si-O COMPLEX IN SILICON CRYSTAL BY MOLECULAR ORBITAL METHOD, Pages 255-258, Atsushi NOGAMI, Tooru MATSUMIYA, William A. GODDARD III A CLASSIFICATION OF THE THIRD-ORDER ORGANIC NONLINEAR OPTICAL SYSTEMS AND PROPOSAL OF NEW-TYPE SYSTEMS, Pages 259-262, Masayoshi NAKANO, Kizashi YAMAGUCHI, Takayuki FUENO AB INITIO MOLECULAR ORBITAL CALCULATIONS OF THIRD-ORDER HYPERPOLARIZABILITIES OF ORGANIC MOLECULES, Pages 263-266, Koji OHTA, Toshio FUKUMI, Toru SAKAGUCHI RECENT PROGRESS IN ELECTRONIC STRUCTURE CALCULATIONS FOR DEFECTS IN METALS, Pages 269-274, R. Zeller, B. Drittler, P.H. Dederichs, U. Klemradt, M. Weinert KROECKEL DENSITY-FUNCTIONAL MOLECULAR-DYNAMICS STUDY ON DEFECTS IN ALUMINUM, Pages 275-278, Tamio OGUCHI, Taizo SASAKI CALCULATION OF ELECTRONIC STATE OF DISLOCATIONS IN COVALENT SEMICONDUCTORS: EFFECT OF CORE RECONSTRUCTION AND SOLITON, Pages 279-283, Kinichi MASUDA-JINDO DAMPING CONSTANTS OF MOVING DISLOCATIONS IN ALUMINIUM AND COPPER CRYSTALS, Pages 285-288, Yoshiko H. OHASHI, Kazutoshi OHASHI, Mitsuru FUKUCHI THEORETICAL ANALYSIS OF THE DAMPING CONSTANT OF VIBRATING DISLOCATION IN ALKALI HALIDES, Pages 289-292, Kazutoshi OHASHI, Yoshiko H. OHASHI, Mitsuru FUKUCHI TIGHT-BINDING APPROACHES TO GRAIN BOUNDARIES IN SEMICONDUCTORS AND CERAMICS, Pages 293-298, Masanori KOHYAMA, Ryoichi YAMAMOTO TIGHT-BINDING CALCULATION OF ATOMIC AND ELECTRONIC STRUCTURE OF TILT GRAIN BOUNDARIES IN SI, Pages 299-304, Yoichi WATANABE, Masanori KOHYAMA, Ryoichi YAMAMOTO AN ATOMISTIC AND ELECTRONIC STUDY OF GRAIN BOUNDARY EMBRITTLEMENT FOR METAL COPPER INDUCED BY BISMUTH SEGREGATION, Pages 305-310, Xi-jun WU, Ba-yi PENG, Fu-xin ZHOU, Qing-qi ZHENG, Qi-heng TANG THEORETICAL STUDY ON THE BENDING OF COMMON (111) PLANE AT INCOHERENT TWIN BOUNDARY IN AUSTENITIC STAINLESS STEEL, Pages 311-314, M. MORI, K. MASUDA-JINDO, K. TANAKA, Y. ISHIDA INTERACTION ENERGY BETWEEN IMPURITIES AND GRAIN BOUNDARIES IN IRON, Pages 315-318, R. YAMAMOTO, K. MASUDA-JINDO PHYSICAL CONSTANTS OF SMALL VACANCY CLUSTERS IN PURE CU, AG AND AU CALCULATED BY THE EMBEDDED ATOM METHOD, Pages 319-322, Yoshiharu SHIMOMURA, Rieko NISHIGUCHI, Hidefumi NAGATA, Tomas Diaz DE LA RUBIA, Michael W. GUINAN COMPUTER SIMULATION OF VOID SWELLING IN METALS AND ALLOYS, Pages 323-326, Eiichi KURAMOTO BINARY COLLISION “MARLOWE” CODE SIMULATION OF THE POINT DEFECT STRUCTURE OF DISPLACEMENT DAMAGE CASCADES IN NEUTRON-IRRADIATED CU AND NI, Pages 327-330, Yoshiharu SHIMOMURA, Nishio WATANABE, Rieko NISHIGUCHI COMPUTER DESIGNING OF EXPERIMENTS APPROPRIATE FOR THE STUDY OF MATERIALS DAMAGING IN FUTURE FUSION REACTOR IRRADIATION ENVIRONMENTS, Pages 331-334, Rieko NISHIGUCHI, Yoshiharu SHIMOMURA, Peter A. HAHN, Michael W. GUINAN, Michio KIRITANI A COMPUTER SIMULATION OF CRACK EXTENSION IN β-SiC, Pages 335-338, Akitaka Sawamura, Yoichi Watanabe, Ryoichi Yamamoto MOLECULAR DYNAMICS SIMULATIONS IN CONDENSED MATTER PHYSICS, Pages 341-346, Shuichi NOSÉ MOLECULAR DYNAMICS SIMULATION OF SOME MOLTEN SALTS–RELATION BETWEEN ELECTRIC CONDUCTIVITY AND SELF-EXCHANGE VELOCITY, Pages 347-352, Isao OKADA STATISTICAL GEOMETRY OF THE SHORT-RANGE ORDER IN MONATOMIC AMORPHOUS SYSTEMS, Pages 353-358, Minoru TANAKA COMPUTER SIMULATION OF RADIATION DAMAGE IN AMORPHOUS SOLIDS, Pages 359-364, Risto M. Nieminen STRUCTURAL FLUCTUATIONS IN ARGON MICROCLUSTERS, Pages 365-370, H. Matsuola, T. Hirokawa, T. Uchida, M. Matsui, M. Doyama STRUCTURAL FLUCTUATIONS IN GOLD MICROCLUSTERS, Pages 371-374, T. Uchida, H. Matsuoka, H. Matsui, M. Doyama AN ATTEMPT TO SIMULATE THE CLUSTER DEPOSITION PROCESS, Pages 375-377, Yasushi SASAJIMA, Toshio SAKUTA, Satoru OZAWA, Ryoichi YAMAMOTO MOLECULAR-DYNAMICS SIMULATIONS FOR LOW ENERGY ION BEAM THIN FILM FORMATION PROCESS AT DIFFERENT INCIDENT BEAM ENERGY AND SUBSTRATE TEMPERATURE, Pages 379-380, Takashi KAWAKUBO NEW CRYSTAL STRUCTURES OF SiO2 PREDICTED BY MOLECULAR DYNAMICS STUDY, Pages 381-384, Shinji Tsuneyuki, Hideo Aoki, Yoshito Matsui MOLECULAR DYNAMICS SIMULATION OF MIXED ALKALI HALIDE GLASS, Pages 385-388, Kenichi KINUGAWA, Kohei KADONO, Hiroshi TANAKA NON-EQUILIBRIUM MOLECULAR DYNAMICS SIMULATION OF VISCOSITY OF FLUORIDE GLASS MELT, Pages 389-392, Tetsuji YANO, Masayuki YAMANE, Satoru INOUE MOLECULAR DYNAMICS SIMULATION OF MOLTEN LITHIUM BROMIDE, Pages 393-396, Sumiko ITOH, Takeo MATSUZAWA, Makoto KONAGAI, Kiyoshi TAKAHASHI COMPUTER SIMULATION ON A VACANCY AND DISLOCATIONS IN ORGANIC CRYSTALS, Pages 397-400, Isamu OKADA, Naoki IDE, Kenichi KOJIMA SIMULATIONS FOR DYNAMIC BEHAVIORS OF XYLENES INSIDE THE PORES OF PENTASIL ZEOLITIC CATALYSTS USING FORCE FIELD CALCULATION, Pages 401-404, Yoshiaki NAKAZAKI, Tomoyuki INUI STUDY ON INTERFACIAL STRUCTURE OF Cu-Fe ALLOY USING MOLECULAR DYNAMICS, Pages 405-408, Takashi Arai, Katsuaki Suganuma FAST ALGORITHM FOR COVERING CONFORMATIONAL SPACE BY MOLECULAR MECHANICS, Pages 411-416, Eiji Osawa, Hitoshi Goto COMPUTER AIDED DESIGN OF ARTIFICIAL PROTEINS, Pages 417-422, Haruki NAKAMURA The SPECTRE System As Advanced Tool for Global Experimental Optimization, Pages 423-428, Mario Marsili, Mototsugu Yoshida, Yasuo Kikuzono, Hiroyuki Katsumi SPECINFO - A MULTIDIMENSIONAL INTERPRETATION SYSTEM, Pages 429-432, Reinhard NEUDERT AUTOMATIC RECOGNITION OF COMMON STRUCTURAL FEATURES AMONG CHEMICAL COMPOUNDS USING REDUCED STRUCTURE REPRESENTATION BASED ON FUNCTIONAL GROUPS, Pages 433-438, Yoshimasa TAKAHASHI, Masayuki SUKEKAWA, Shin-ichi SASAKI COMPUTER APPLICATIONS IN PROTEIN ENGINEERING, Pages 439-442, Toru YAO A DYNAMIC AND STEREOGRAPHIC VISUALIZATION OF A MOLECULE BY THE TECHNIQUES OF MOLECULAR DYNAMICS SIMULATIONS, COMPUTER GRAPHICS, AND MULTIPLEX HOLOGRAPHY, Pages 443-446, Sumio Tokita, Atsushi Tomonaga, Keiichiro Ogawa, Takayuki Saito, Yoshitaka Minami, Masane Suzuki, Hiromitsu Imamura, Yoshiya Kogo, Takao Sugiyama, Satoru Toyooka CONFORMATIONAL ANALYSIS OF MIKIMOPINE, Pages 447-450, Kazuhiko Nakamura, Hiroshi Chuman, Akira Isogai, Naoyuki Fukuchi A RAPID ANALYSIS METHOD OF VARIATIONS IN POLYMER CHAIN 1⁄2, Pages 451-454, TOSHIO NAKAO APPLICATIONS OF THE COMPUTER AIDED CHEMISTRY SYSTEM ACACS IN AGRICULTURAL CHEMICAL RESEARCH, Pages 455-460, Yasuyuki KURITA, Chiyozo TAKAYAMA, Toshiyuki KATAGI, Mototsugu YOSHIDA AN OVERVIEW OF CHEMICAL DATABASES, Pages 461-466, David R. Lide PLASTICS MATERIAL DATA BASE filed on a COMPACT DISC (CAPDAS Version 2), Pages 467-470, Shouei FUJISHIGE, Akio SHIMIZU THE POLYMER PROJECT AT BIOSYM TECHNOLOGIES, INC, Pages 471-475, Caibao Qian, J.D. Honeycutt, Stephen J. Mumby, B.E. Eichinger AN ARTIFICIAL INTELLIGENT SYSTEM TO DETECT COMMON FEATURES NECESSARY FOR BIOLOGICAL ACTIVITY : APPLICATION OF ANALOGS FOR ALDOSE REDUCTASE INHIBITORS, Pages 477-480, Tamio YASUKAWA, Katsunori SATOH, Noriaki GOTOH, Toshimasa ISHID, Shigeyuki SUMIYA, Kunihiro KITAMURA MO DESIGN OF FUNCTIONAL DYE MATERIALS, Pages 481-486, Masaru MATSUOKA OPTICAL PERSISTENT HOLE BURNING OF ANTHRAQUINONE DERIVATIVES, Pages 487-490, Yoshihisa KAWAGUCHI MOLECULAR ORBITAL STUDY FOR ELECTRICALLY CONDUCTING POLYTRIPHENYLAMINES, Pages 491-494, Yasuhiko OHSAWA, Hidekazu TAKAHASHI, Yasuyuki MUROFUSHI, Jun-ichi TAKIMOTO THE AUTOMATION OF ORGANIC SYNTHESIS DESIGN: A BEGINNING, Pages 495-498, Mototsugu YOSHIDA, Tetsuhiko TAKABATAKE, Malcolm BERSOHN A QUANTUM CHEMICAL REACTION DESIGN OF A PLASMA CHEMICAL REACTION OF VINYLSILANE, Pages 499-502, Kota SATO, Akihiko UCHIYAMA, Toru ODE, Susumu IWABUCHI, Tsuneo HIRANO, Hideomi KOINUM AB INITIO MO CALCULATION OF THE STRUCTURE AND ENERGY LEVELS OF 7-HYDROXYCOUMARIN AND ITS TAUTOMER, Pages 503-505, Tetsuo MORIYA, Yoshihisa KAWAGUCHI THE STEREOCHEMISTRY OF REDUCTION PRODUCTS OF SANTONIN: EXAMINATION OF CONFORMATIONS BY MM2 CALCULATIONS, Pages 507-510, Jun-ichi Ishiyama, Shin Imaizumi, Akio Karube MOLECULAR MODELING OF ANION SELECTIVE SYNTHETIC LIGANDS BASED ON MOLECULAR MECHANICAL CALCULATIONS EMPLOYING AB INITIO ATOM PAIR POTENTIALS FOR ION-LIGAND INTERACTION ENERGY EVALUATION, Pages 511-514, Takuya MARUIZUMI ELECTROMAGNETIC PHENOMENA IN METALS PROCESSING OPERATIONS, Pages 517-523, Julian SZEKELY THE THEORETICAL ANALYSIS OF A COLD CRUCIBLE, Pages 525-530, Kazuhiko Iwai, Mamoru Kuwabara, Kensuke Sassa, Shigeo Asai MATHEMATICAL MODELING OF MICROWAVE-ASSISTED CHEMICAL VAPOR INFILTRATION FOR THE PRODUCTION OF CERAMIC–CERAMIC COMPOSITES, Pages 531-536, J.W. EVANS, D. GUPTA Electromagnetic Analysis on Cold Crucible for Levitation, Pages 537-540, Takehiko TOH, Marcel GARNIER EFFECT OF ELECTROMAGNETIC PRESSURE ON EARLY SOLIDIFICATION IN A CONTINUOUS CASTING, Pages 541-544, Jun-ichi Sakane, Keiji Tsunenari, Eiichi Takeuchi, Ikuto Miyoshino DEVELOPMENT OF TWO-DIMENSIONAL BLAST FURNACE TOTAL MODEL AND IT'S APPLICATION, Pages 545-548, Takashi SUGIYAMA, Masayasu SUGATA DEVELOPMENT OF A MATHEMATICAL MODEL FOR BURDEN DISTRIBUTION IN A BLAST FURNACE, Pages 549-552, Shinroku MATSUZAKI, Takashi SUGIYAMA, Yoshio OKUNO EFFECTS OF MAGNETIC FIELD ON FLUID FLOW OF SILICON MELT IN CZOCHRALSKI PROCESS, Pages 553-556, Kensuke OKAZAWA, Ikuo SAWADA, Masahiro TANAKA NUMERICAL SIMULATIONS OF FORCED AND NATURAL CONVECTIONS BY THE USE OF NEW CFD ALGORITHM NSMAC, Pages 557-560, Ikuo Sawada, Hidenori Harada THERMAL HISTORY ANALYSIS OF A CZ CRYSTAL WITH LARGE DIAMETER, Pages 561-564, S. MIYAHARA, S. KOBAYASHI, T. FUJIWARA, T. KUBO, H. FUJIWARA COMPUTER SIMULATION IN INJECTION MOLDING OF THERMOPLASTICS, Pages 565-568, Takaaki MATSUOKA, Jun-ichi TAKABATAKE, Akihiko KOIWAI, Yoshinori INOUE, Satoru YAMAMOTO, Hideroh TAKAHASHI SIMULATION FOR POLYMER MELT FLOW IN INJECTION MOLDING, Pages 569-572, Katsuhiko SAGAE, Makoto KOIZUMI, Masanori YAMAKAWA INJECTION MOLDING POLYMER FLOW SIMULATION BY THE FINITE ELEMENT METHOD, Pages 573-576, Akira MIZUKAMI NUMERICAL SIMULATION OF FLOAT GLASS FORMING PROCESS, Pages 577-579, Motoichi IGA, Hiroshi MASE COMPUTER SIMULATION OF SOLIDIFICATION AND ITS APPLICATION TO MATERIALS DEVELOPMENT, Pages 581-585, Itsuo OHNAKA DEVELOPMENT OF A SIMULATOR OF SOLIDIFICATION PATH AND FORMATION OF NONMETALLIC INCLUSIONS DURING SOLIDIFICATION OF STAINLESS STEELS, Pages 587-590, Wataru YAMADA, Tooru MATSUMIYA, Bo SUNDMAN SOLIDIFICATION ANALYSIS OF CRYSTAL GROWTH IN OHNO CONTINUOUS CASTING PROCESS, Pages 591-596, J.C. Liu, J.D. Hwang, K.C. Su CONTACT DESCRIPTIONS IN FINITE ELEMENT SIMULATION OF METAL FORMING PROCESSES, Pages 597-602, Akitake MAKINOUCHI FINITE ELEMENT CONTROL AND MANAGEMENT FOR METAL FORMING PROCESS SIMULATION, Pages 603-608, Tatsuhiko AIZAWA SIMULATIONS OF SHOCK RECOVERY FIXTURES FOR CONDENSED MATTER UNDER HIGH PRESSURES, Pages 609-614, K. TANAKA ATOMISTIC THEORY OF FRACTURE OF BRITTLE MATERIALS, Pages 615-620, K. MASUDA-JINDO, V.K. TEWARY, R. THOMSON Application of Adaptive Remeshing Method to Simulation of Material Forming Processes, Pages 621-624, Nobuki Yukawa, Noboru Kikuchi FINITE ELEMENT CREEP DAMAGE ANALYSIS OF PIPING, Pages 625-628, Noriyuki MIYAZAKI, Yuuichiro AIHARA, Seiya HAGIHARA, Tsuyoshi MUNAKATA A NUMERICAL ANALYSIS OF IMPULSIVE STRESS IN A GLASS PLATE USING THE FINITE ELEMENT METHOD, Pages 629-632, Hidemi KATOH, Kozo NOMOTO PLASTIC DAMAGE MODELING OF ANISOTROPIC SHEET STEEL FORMING, Pages 633-636, Y.L. Kang, X.J. Wang, J. Kihara, T. Aizawa MATHEMATICAL MODEL FOR PREDICTING MICROSTRUCTURE AND STRENGTH OF HOT ROLLED STEELS, Pages 637-640, Takehide SENUMA, Masayoshi SUEHIRO, Hiroshi YADA, Satoshi AKAMATSU, Kazuaki SATO DEVELOPMENT OF A METALLURGICAL MODEL FOR THE PREDICTION OF PEARLITE TRANSFORMATION AND ITS APPLICATION TO HIGH-CARBON SHEET STEEL PRODUCTION, Pages 641-644, Nozomi KOMATSUBARA, Kazutoshi KUNISHIGE FINITE ELEMENT SIMULATION OF THREE-DIMENSIONAL DEFORMATION IN PUNCH STRETCHING OF SHEET METALS, Pages 645-648, Ken-ichiro MORI, Tatsuji KAWAGUCHI, Katsuhiko YAMAGUCHI DEVELOPMENT OF A SHAPE MODEL FOR QUALITATIVE ANALYSIS, Pages 649-652, Shuichi FUKUDA PREDICTION OF SECONDARY RECRYSTALLIZATION TEXTURE BY COMPUTER SIMULATION, Pages 653-656, J. Harase, R. Shimizu, Y. Nakamura, N. Takahashi A MATHEMATICAL MODEL FOR PHASE TRANSFORMATION PLASTICITY USING FINITE ELEMENT METHOD, Pages 657-660, Hiroshi Shigefuji, Toshihiko Ariyoshi PROCESS SIMULATIONS OF HIP AND CIP, Pages 661-666, Tomokazu NAKAGAWA, Akira NOHARA A FINITE ELEMENT ANALYSIS OF ELECTROMAGNETIC FORMING FOR TUBE EXPANSION, Pages 667-672, Sung Ho LEE, Dong Nyung LEE THEORETICAL STUDIES OF SILICON CRYSTAL GROWTH MECHANISM BY AB INITIO MOLECULAR ORBITAL CALCULATIONS, Pages 675-679, Yoshio Ohshita, Toshikazu Takada, Akihiko Ishitani SURFACE ENERGIES AND ORDER-STATE: EFFECTS ON SEMICONDUCTOR GROWTH, Pages 681-686, Srinivasan KRISHNAMURTHY, M.A. BERDING, A. SHER, A.-B. CHEN MOLECULAR DYNAMICS SIMULATIONS OF MOLECULAR BEAM EPITAXY, Pages 687-692, G.H. Gilmer, A.F. Bakker MOLECULAR-DYNAMICS SIMULATION OF MOLECULAR-BEAM-EPITAXY USING LENNARD-JONES AND EMPIRICAL Si POTENTIALS, Pages 693-698, Itsuo UMEBU, Minoru IKEDA, Takahiro YAMASAKI, Kumiko FURUYA, Kiyoyuki TERAKURA ATOMIC–SCALE CALCULATIONS AND SIMULATIONS FOR MATERIALS SYNTHESIS AND DESIGN, Pages 699-704, D.D. VVEDENSKY, S. CLARKE, S. CRAMPIN DYNAMICAL DIFFRACTION CALCULATIONS FOR RHEED INTENSITY OSCILLATIONS DURING MBE GROWTH, Pages 705-710, L.-M. Peng, M.J. Whelan COMPUTER SIMULATION OF STRAIN RELAXATION MECHANISM OF MBE GROWN LATTICE MISMATCHED InGaAs/GaAs LAYERS, Pages 711-714, Masao Tabuchi, Susumu Noda, Akio Sasaki AN OBJECT ORIENTED DATA BASE SYSTEM FOR DESIGN OF SEMICONDUCTOR MATERIALS AND DEVICES, Pages 715-718, Hachiro IJUIN, Shun-ichi GONDA BAND OFFSET OF AIGalnAsSb ALLOY SEMICONDUCTOR, Pages 719-722, Tadaaki Kaneko, Shun-ichi Gonda, Hajime Asahi Simulation of ULSI Processes and Devices, Pages 723-728, Hans KOSINA, Karl WIMMER, Claus FISCHER, Siegfried SELBERHERR Multi-Dimensional Numerical Modeling for Thermal Oxidation of Silicon, Pages 729-734, Hiroyuki UMIMOTO, Shinji ODANAKA SIMULATION OF THREE-DIMENSIONAL NEGATIVE PHOTORESIST IMAGES USING PHASE-SHIFTING MASK, Pages 735-739, Tatsumi ISHIZUKA VLSI PROCESS SIMULATION AND ITS APPLICATION TO BIPOLAR DEVICE FABRICATION, Pages 741-744, Kenji Nishi, Shigeki Kuroda, Nobuyoshi Shimizu, Yoshihisa Okita MONTE CARLO SIMULATION OF IONIZATION PHENOMENA IN Si-MOSFET'S, Pages 745-748, Nobuyuki SANO, Masaaki TOMIZAWA, Akira YOSHII MONTE CARLO SIMULATION FOR VELOCITY OVERSHOOT EFFECTS IN HETEROJUNCTION BIPOLAR TRANSISTORS, Pages 749-752, Masaaki TOMIZAWA, Hideaki TANIYAMA, Tomofumi FURUTA, Akira YOSHII ENSEMBLE MONTE CARLO SIMULATION OF SUBMICRON GaAs TRANSISTORS INCLUDING PAULI EXCLUSION PRINCIPLE, Pages 753-756, Yoshinori YAMADA, Yoshiaki MATSUGUMA, Toshimitsu KOURA TWO–DIMENSIONAL SIMULATOR OF GaAlAs/GaAs AND InGaAsP/InP HETEROSTRUCTURE LASERS, Pages 757-761, Tsukuru OHTOSHI, Ken YAMAGUCHI SIMULATION OF CURRENT DENSITY AND TEMPERATURE AROUND DEFECTS IN ZnO VARISTOR MATERIALS, Pages 763-766, Naohito Yamada, Takao Soma MODELS FOR THE MATHEMATICAL MODELING OF THE PERFORMANCE OF ZnO VARISTOR, Pages 767-769, CAO, ZE-CHUN, SONG, RUN-SHENG CALPHAD ANALYSIS OF MATERIALS PROCESSING AND PERFORMANCE, Pages 773-778, Larry Kaufman AN ATTEMPT OF FIRST PRINCIPLE CALCULATION OF ALLOY PHASE DIAGRAM, Pages 779-784, Tooru MATSUMIYA, Hideaki SAWADA, Wataru YAMADA, Atsushi NOGAMI COMPUTER MODELING OF PHASE STABILITIES, Pages 785-790, T.B. Massalski, H. Baxi, S. Pei, S. Noguchi PHASE STABILITY AND DIAGRAMS: A CASE STUDY IN COMPUTATIONAL MATERIALS ENGINEERING, Pages 791-794, J.M. SANCHEZ, J.D. BECKER, A.E. CARLSSON THERMO-CALC, A GENERAL TOOL FOR PHASE DIAGRAM CALCULATIONS, Pages 795-798, Bo Sundman A PSEUDOPOTENTIAL APPROACH TO SYSTEMATIC INVESTIGATION OF MIXING ENTHALPIES FOR SEMICONDUCTOR ALLOY SYSTEMS, Pages 799-802, Tomonori ITO ALLOY DESIGN BASED ON MOLECULAR ORBITAL METHOD, Pages 803-808, Masahiko MORINAGA, Natsuo YUKAWA MONTE CARLO SIMULATION OF MICROSTRUCTURAL EVOLUTION IN STEEL, Pages 809-814, Yoshiyuki Saito, Masato Enomoto COMPUTATIONAL MODEL FOR PREDICTING MICROSTRUCTURES AND MECHANICAL PROPERTIES IN MANUFACTURING OF HEAVY STEEL PLATES, Pages 815-818, Atsuhiko YOSHIE, Masa-aki FUJIOKA, Yasumitsu ONOE, Kiyoshi NISHIOKA COMPUTER SIMULATION OF MICROSTRUCTURAL CHANGES IN THERMOMECHANICAL PROCESSING OF 18Cr-8Ni AND 9Cr-1Mo-V-Nb STEELS, Pages 819-822, Yoshiyuki SAITO, Akihiro MATSUZAKI, Chiaki SHIGA SPINODAL DECOMPOSITION SIMULATION OF α′ PHASE IN FERRITIC STAINLESS STEELS, Pages 823-826, Akihiko HIRANO, Norimasa CHIBA, Yuichi ISHIKAWA EXPLORATORY STUDY ON PROVIDING AUSTENITIC STAINLESS STEELS DESIGNED FOR NUCLEAR APPLICATIONS, Pages 827-830, Hajime NAKAJIMA, Susumu ISOBE, Katsutoshi WATANABE, Tatsuo KONDO NICKEL-BASE SINGLE CRYSTAL SUPERALLOYS DESIGNED BY A d-ELECTRONS CONCEPT, Pages 831-834, Kazuhiro MATSUGI, Yoshinori MURATA, Masahiko MORINAGA, Natsuo YUKAWA THERMODYNAMICS AIDED DESIGN OF α+α 2HIGH TEMPERATURE TITANIUM ALLOYS, Pages 835-838, Hidehiro ONODERA, Sizuo NAKAZAWA, Katsumi OHNO, Toshihiro YAMAGATA, Michio YAMAZAKI THEORETICAL STUDY ON ENHANCED DUCTILITY OF MO-RE ALLOYS, Pages 839-842, K. MASUDA-JINDO, S. TAKEUCHI COMPUTER SIMULATION OF THE INTERFACIAL ENERGY BETWEEN BCC/FCC INTERFACES, Pages 843-846, Yoshihiko GOTOH, Hiroshi FUKUDA COMPUTER SIMULATION OF HIGH-RESOLUTION ELECTRON MICROSCOPE IMAGES OF LAMELLAR BOUNDARIES IN TiAl, Pages 847-852, Haruyuki INUI, Atusi NAKAMURA, Myung-Hoon OH, Masaharu YAMAGUCHI KINETICS OF PHASE STABILITY OF INTERMETALLIC COMPOUNDS, Pages 853-856, Tetsuo MOHRI, Yasutaka SUGAWARA COMPUTER SIMULATION OF LOCAL ATOMIC DISPLACEMENTS IN DIFFUSE OMEGA PHASE, Pages 857-860, Naohisa TAKESUE, Masahiko MORINAGA, Natsuo YUKAWA, Masato KATO, Ken-ichi OSHIMA, Jimpei HARADA, Satoshi SASAKI, Shuji HANADA REVERSE MONTE CARLO SIMULATION OF AMORPHOUS Pd80Si20 ALLOY, Pages 861-864, Yoshihiro OKAMOTO, Ryuzo TAKAGI MODEL STRUCTURES OF AMORPHOUS ALLOYS DERIVED FROM A MODEL ICOSAHEDRAL PHASE, Pages 865-868, Tetsushoku TEI, Keiichi EDAGAWA, Kaoru KIMURA, Shin TAKEUCHI MODELLING MESOSCOPIC SYSTEMS, Pages 869-872, T.C. CHOY, J.H. HARDING, A.H. HARKER, P.A. MULHERAN, L.W. SMITH, A.M. STONEHAM SOME ASPECTS OF COMPUTER UTILIZATION IN MATERIALS DESIGN DIVISION OF NRIM, Pages 873-878, Ken'ichi Hoshimoto, Michio Yamazaki A PERSONAL COMPUTER DATA BASE FOR METALLIC STRUCTURAL MATERIALS: CODE & STANDARD SECTION, Pages 879-882, Franco CESARI, Arnaldo CHIARINI, Anna Grazia GANDINI DESIGN OF NEW GLASS STRUCTURE AND PROPERTIES BY MOLECULAR DYNAMICS METHOD, Pages 885-890, Kazuyuki HIRAO MATERIALS DESIGN OF GLASS AND DEVELOPMENT OF IMPROVED EXPERT SYSTEM, Pages 891-896, Akio MAKISHIMA, Mamoru MITOMO, Hideki MONMA, Nobuyasu MIZUTANI, Itaru YASUI, Tosirou FUTAGAMI MATERIAL DESIGN OF CERAMICS AND GLASSES – GLASS DATABASE AND CERAMIC DESIGN SYSTEM, Pages 897-902, Itaru YASUI EXPERT SYSTEM FOR THE DEVELOPMENT OF SILICON NITRIDE CERAMICS, Pages 903-906, Mamoru MITOMO, Hideki MONMA, Takayasu IKEGAMI, Akio MAKISHIMA STRUCTURE OF FLUOROPHOSPHATE GLASSES, Pages 907-910, H. Inoue, A. Makishima AN X-RAY DIFFRACTION AND MOLECULAR DYNAMICS INVESTIGATION OF SOME ALKALI FLUOROBERYLLATE GLASSES AND MELTS, Pages 911-914, Norimasa UMESAKI, Hideo OHNO, Nobuya IWAMOTO A MICROSCOPIC CALCULATION OF THERMAL PROPERTIES OF IONIC SOLID SOLUTIONS, Pages 915-918, Shinji NAMBU, Masaki OIJI ORIENTED MOSAIC MODEL CHARACTERIZING HOT-PRESSED Bi2 Te3, Pages 919-922, Hideo WADA, Youichi OKAMOTO, Toru MIYAKAWA, Taizo IRIE PREMAT/POSTMAT : A COMPUTER SOFTWARE FOR COMPUTATIONAL MECHANICS OF COMPOSITE MATERIALS, Pages 925-934, Jose Miranda GUEDES, Noboru KIKUCHI FINITE ELEMENT ANALYSIS OF AN INTERFACE CRACK BETWEEN DISSIMILAR DUCTILE MATERIALS, Pages 935-940, Shigeru AOKI, Kikuo KISHIMOTO, Noriyasu TAKEUCHI SHAPE OPTIMIZATION FOR REDUCING STRESS AT CERAMICS/METAL JOINTS, Pages 941-944, Hidekazu MURAKAWA, Yukio UEDA A DESIGN EXPERT SYSTEM FOR FUNCTIONALLY GRADIENT MATERIALS, Pages 945-950, Tohru Hirano MATHEMATICAL MODELING OF ELECTROMAGNETIC CASTING OF METALS AND SOME EXPERIMENTAL VERIFICATION, Pages 951-956, James W. EVANS, Daniel P. COOK NUMERICAL ANALYSIS OF MASS DIFFUSION AND HEAT CONDUCTION PHENOMENA IN METAL/CARBIDE COMPOSITE BY THERMOMIGRATION, Pages 957-960, Tomoyasu AIHARA, Mikio KAJI, Tadashi IGARASHI MATERIAL DESIGN OF MMC USING FEM, Pages 961-964, Keizo HASHIMOTO, Shouichi SEKIGUCHI, Katsutoshi YAMADA MODELING OF NANOMETER SCALE COMPOSITE STRUCTURES FORMED BY OBLIQUE DEPOSITION OF TWO MATERIALS FROM DIFFERENT DIRECTIONS, Pages 965-968, Yasuhiko TAKEDA, Tomoyoshi MOTOHIRO, Shoji NODA AUTHOR INDEX, Pages 969-973 Subject Index, Pages 975-984