Chemical Interaction of NF₃ with Si (Part II): Density Functional Calculation Studies, A. Endou, T. W. Little, A. Yamada, K. Teraishi, M. Kubo, Salai Cheettu Ammal, A. Miyamoto, M. Kitajima, F. S. Ohuchi
Faculty Publications

Computer-Aided Design of Novel Heterogeneous Catalysts—A Combinatorial Computational Chemistry Approach, K. Yajima, Y. Ueda, H. Tsuruya, T. Kanougi, Y. Oumi, Salai Cheettu Ammal, S. Takami, M. Kubo, A. Miyamoto
Faculty Publications

Combinatorial Computational Chemistry Approach to the Design of Metal Oxide Electronics Materials, B. Rodion, Salai Cheettu Ammal, Y. Inaba, Y. Oumi, S. Takami, M. Kubo, A. Miyamoto, M. Kawasaki, M. Yoshimoto, H. Koinuma
Faculty Publications

Combinatorial Computational Chemistry Approach to the Design of deNO_x Catalysts, K. Yajima, Y. Ueda, H. Tsuruya, T. Kanougi, Y. Oumi, Salai Cheettu Ammal, S. Takami, M. Kubo, A. Miyamoto
Faculty Publications

Tight-Binding Molecular Dynamics Simulation of Desorbed SiO Molecule during the Oxidation of Si(111) Surface, A. Yamada, A. Endou, H. Takaba, K. Teraishi, Salai Cheettu Ammal, M. Kubo, K. G. Nakamura, M. Kitajima, A. Miyamoto
Faculty Publications

Periodic Boundary Quantum Chemical Study on ZnO Ultra-Violet Laser Emitting Materials, Y. Oumi, H. Takaba, Salai Cheettu Ammal, M. Kubo, K. Teraishi, A. Miyamoto, M. Kawasaki, M. Yoshimoto, H. Koinuma
Faculty Publications

Computational Studies on GaN Surface Polarity and InN/GaN Heterostructures by Density Functional Theory and Molecular Dynamics, T. Onozu, I. Gunji, R. Miura, Salai Cheettu Ammal, M. Kubo, K. Teraishi, A. Miyamoto, Y. Iyechika, T. Maeda
Faculty Publications

NH₃ Adsorption on the Brönsted and Lewis Acid Sites of V₂O₅ (010):  A Periodic Density Functional Study, X. Yin, H. Han, I. Gunji, A. Endou, Salai Cheettu Ammal, M. Kubo, A. Miyamoto
Faculty Publications

Adsorption of H₂O on the V₂O₅ (010) Surface Studied by Periodic Density Functional Calculations, X. Yin, A. Fahmi, H. Han, A. Endou, Salai Cheettu Ammal, M. Kubo, K. Teraishi, A. Miyamoto
Faculty Publications