Department of Quantum Engineering and Systems Science

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#	Title	Journal	Year	Citations
1	Band gap narrowing of titanium dioxide by sulfur doping	Applied Physics Letters	2002	1,376
2	Preparation of S-doped TiO2 photocatalysts and their photocatalytic activities under visible light	Applied Catalysis A: General	2004	1,177
3	Analysis of electronic structures of 3d transition metal-doped TiO 2 based on band calculations	Journal of Physics and Chemistry of Solids	2002	641
4	Sulfur-doping of rutile-titanium dioxide by ion implantation: Photocurrent spectroscopy and first-principles band calculation studies	Journal of Applied Physics	2003	290
5	Nonlinear optical property calculations by the long-range-corrected coupled-perturbed Kohn–Sham method	Journal of Chemical Physics	2005	278
6	Large-scale discrete element modeling in pneumatic conveying	Chemical Engineering Science	2009	263
7	Fabrication and characterization of C-doped anatase TiO2photocatalysts	Journal of Materials Science	2004	230
8	Thermal lattice Bhatnagar-Gross-Krook model without nonlinear deviations in macrodynamic equations	Physical Review E	1994	224
9	Electronic and Excitonic Structures of Inorganic–Organic Perovskite-Type Quantum-Well Crystal (C4H9NH3)2PbBr4	Japanese Journal of Applied Physics	2005	198
10	Image charge effect on two-dimensional excitons in an inorganic-organic quantum-well crystal	Physical Review B	2005	186
11	A density-functional study on π-aromatic interaction: Benzene dimer and naphthalene dimer	Journal of Chemical Physics	2005	177
12	Solution coordination chemistry of actinides: Thermodynamics, structure and reaction mechanisms	Coordination Chemistry Reviews	2006	177
13	Multiphoton ionization ofHeby using intense high-order harmonics in the soft-x-ray region	Physical Review A	2005	159
14	Photoemission and Ionization ofHe+under Simultaneous Irradiation of Fundamental Laser and High-Order Harmonic Pulses	Physical Review Letters	2003	158
15	Observation of a single-beam gradient-force optical trap for dielectric particles in air	Optics Letters	1997	152
16	Implicit constitutive modelling for viscoplasticity using neural networks	International Journal for Numerical Methods in Engineering	1998	142
17	Quantum Path Interference in the Wavelength Dependence of High-Harmonic Generation	Physical Review Letters	2007	140
18	Computer simulation of trabecular remodeling in human proximal femur using large-scale voxel FE models: Approach to understanding Wolff's law	Journal of Biomechanics	2009	125
19	Dramatic Enhancement of High-Order Harmonic Generation	Physical Review Letters	2007	122
20	Surface Photovoltage NO Gas Sensor with Properties Dependent on the Structure of the Self-Ordered Mesoporous Silicate Film	Advanced Materials	2002	116
21	Preparation and characterization of natural lower dimensional layered perovskite-type compounds	Journal of Physics and Chemistry of Solids	2000	108
22	Scintillation properties of (C6H13NH3)2PbI4: Exciton luminescence of an organic/inorganic multiple quantum well structure compound induced by 2.0 MeV protons	Nuclear Instruments & Methods in Physics Research B	2002	105
23	First-Principles Calculation of Point Defects in Uranium Dioxide	Materials Transactions	2006	104
24	Ceramic breeder material development	Fusion Engineering and Design	1998	102
25	LSDA+Ucalculations">Point defects and clustering in uranium dioxide byLSDA+Ucalculations	Physical Review B	2008	100
26	Neural networks in computational mechanics	Archives of Computational Methods in Engineering	1996	99
27	High-speed micro-PIV measurements of transient flow in microfluidic devices	Measurement Science and Technology	2004	99
28	Structural behavior of uranium dioxide under pressure byLSDA+Ucalculations	Physical Review B	2007	97
29	Measurement of RBC deformation and velocity in capillaries in vivo	Microvascular Research	2006	80
30	Numerical analysis of shipping water impact on a deck using a particle method	Ocean Engineering	2007	80
31	Recent developments of free mesh method	International Journal for Numerical Methods in Engineering	2000	77
32	Theoretical Gibbs free energy study on UO2(H2O)n2+ and its hydrolysis products	Chemical Physics Letters	2001	74
33	An inference method of team situation awareness based on mutual awareness	Cognition, Technology and Work	2005	74
34	The structure of monomeric and dimeric uranyl adsorption complexes on gibbsite: A combined DFT and EXAFS study	Geochimica Et Cosmochimica Acta	2009	73
35	Study on Electronic Structure and Optoelectronic Properties of Indium Oxide by First-Principles Calculations	Japanese Journal of Applied Physics	1997	72
36	Application of a cubic-like mesoporous silica film to a surface photovoltage gas sensing system	Microporous and Mesoporous Materials	2002	72
37	The primary origin of dose rate effects on microstructural evolution of austenitic alloys during neutron irradiation	Journal of Nuclear Materials	2002	69
38	Hydration numbers of pentavalent and hexavalent uranyl, neptunyl, and plutonyl	Computational and Theoretical Chemistry	2000	68
39	Deadlock-free motion planning using the Laplace potential field	Advanced Robotics	1992	65
40	Pore size controlled mesoporous silicate powder prepared by triblock copolymer templates	Materials Letters	2002	63
41	Analysis of Copper Binding in the Ternary System Cu2+/Humic Acid/Goethite at Neutral to Acidic pH	Environmental Science & Technology	2005	63
42	INELASTIC CONSTITUTIVE PARAMETER IDENTIFICATION USING AN EVOLUTIONARY ALGORITHM WITH CONTINUOUS INDIVIDUALS	International Journal for Numerical Methods in Engineering	1997	61
43	Quantum Mechanical and Molecular Dynamical Simulations on Thorium(IV) Hydrates in Aqueous Solution	Journal of Physical Chemistry A	2001	60
44	Non-stoichiometry and its effect on thermal properties of Li2TiO3	Fusion Engineering and Design	2002	60
45	Hamiltonian moving-particle semi-implicit (HMPS) method for incompressible fluid flows	Computer Methods in Applied Mechanics and Engineering	2007	60
46	Immiscible real-coded lattice gas	Computer Physics Communications	2000	58
47	Dynamic p-adaptive Runge–Kutta discontinuous Galerkin methods for the shallow water equations	Computer Methods in Applied Mechanics and Engineering	2009	56
48	An automated system for simulation and parameter identification of inelastic constitutive models	Computer Methods in Applied Mechanics and Engineering	2002	51
49	Comparison of Liquid-Phase and Gas-Phase Pure Thermal Cracking ofn-Hexadecane	Industrial & Engineering Chemistry Research	1996	47
50	INFLUENCE OF GIBBSITE SURFACE AREA AND CITRATE ON Ni SORPTION MECHANISMS AT pH 7.5	Clays and Clay Minerals	2002	47

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