[1]
|
IPCC Fourth Assessment Report.
|
[2]
|
NEDO Report of Renewable Energy Technology [in Japanese].
|
[3]
|
M. Saito, T. Fujitani, M. Takeuchi and T. Watanabe, “Development of Copper/Zinc Oxide-Based Multicomponent Catalysts for Methanol Synthesis from Carbon Dioxide and Hydrogen,” Applied Catalysis A: General, Vol. 138, No. 2, 1996, pp. 311-318.
doi:10.1016/0926-860X(95)00305-3
|
[4]
|
T. Imai, S. Yasutake, K. Kuroda, M. Hirano and T. Akano, “Mitsubishi Jyuko Gihiou,” Technical Report of Mitsubishi Heavy Industries, LTD., Vol. 35, No. 6, 1998. [in Japanese].
|
[5]
|
K. Ushikoshi, Kobe Steel Engineering Reports, Vol. 47, No. 3, 1997. [in Japanese].
|
[6]
|
H. Nakatsuji and Z.-M. Hu, “Mechanism of Methanol Synthesis on Cu(100) and Zn/Cu(100) Surfaces: Comparative Dipped Adcluster Model Study,” International Journal of Quantum Chemistry, Vol. 77, No. 1, 2000, pp. 341-349. doi:10.1002/(SICI)1097-461X(2000)77:1<341::AID-QUA33>3.0.CO;2-T
|
[7]
|
M. Takagawa and M. Ohsugi, “Study on Reaction Rates for Methanol Synthesis from Carbon Monoxide, Carbon Dioxide, and Hydrogen,” Journal of Catalist, Vol. 107, No. 1, 1987, pp. 161-172.
doi:10.1016/0021-9517(87)90281-8
|
[8]
|
H. Eyring, “The Theory of Rate Process I,” Yoshioka Shoten, Tokyo, 2000. [in Japanese].
|
[9]
|
R. Kubo, “Daigaku Enshuu Toukei Netsu Rikigakutoukei Rikigaku (Problems of Statistical Mechanics and Thermo Dynamics for Exercise in University),” Shokabo, Tokyo, 1961. [in Japanese].
|
[10]
|
S. Okude, F. Matsushima, H. Kuze and T. Shimizu, “Molecular Beam Studies of Thermal Decomposition of Glycine on Solid Surfaces,” Japanese Journal of Applied Physics, Vol. 26, 1987, pp. 627-632.
doi:10.1143/JJAP.26.627
|
[11]
|
J. J. P. Stewart, “Optimization of Parameters for Semiempirical Methods V: Modification of NDDO Approximations and Application to 70 Elements,” Journal of Molecular Modeling, Vol. 13, No. 12, 2007, pp. 1173-1213.
doi:10.1007/s00894-007-0233-4
|
[12]
|
R. O. Freire and A. M. Simas, to be submitted.
|
[13]
|
M. J. S. Dewar and H. S. Rzepa, “Ground States of Molecules. 39. MNDO Results for Molecules Containing Beryllium,” Journal of the American Chemical Society, Vol. 100, No. 3, 1978, pp. 777-784.
doi:10.1021/ja00471a020
|
[14]
|
S. Okude, “Calculation on Empirical Model of Chemical Properties of Phosphate Glass for MOS Capacitor,” Japanese Journal of Applied Physics, Vol. 44, 2005, pp. 3175-3176. doi:10.1143/JJAP.44.3175
|
[15]
|
A. Sierraalta, R. A?ez, L. Diaz and R. Gomperts, “Interaction of CO Molecule with Au/MOR Catalyst: ONIOM-PM6 Study, Active Sites, Thermodynamic and Vibrational Frequencies,” The Journal of Physical Che- mistry A, Vol. 114, No. 25, 2010, pp. 6870-6878.
doi:10.1021/jp102458p
|
[16]
|
H. Kagawa, H. Kikuchi, G. Qi and T. Ogihara, Journal of Computer Chemistry, Vol. 9, 2010, pp. 37-42.
|
[17]
|
M. de la Reforma, ECS Transaction, Vol. 20, 2009, pp. 507-517.
|
[18]
|
H. Deuss and A. van der Avoird, “Model for Dissociative H2 Chemisorption on Transition Metals,” Physical Re- view B, Vol. 8, No. 6, 1973, pp. 2441-2444.
doi:10.1103/PhysRevB.8.2441
|