Ground State Energy Shift of He and Close to a Surface: A Confinement Model (English)
- New search for: Cruz, Salvador A.
- New search for: Ley‐Koo, Eugenio
- New search for: Cabrera‐Trujillo, Remigio
- New search for: Cruz, Salvador A.
- New search for: Ley‐Koo, Eugenio
- New search for: Cabrera‐Trujillo, Remigio
- New search for: Simos, Theodore E.
- New search for: Maroulis, George
In:
AIP Conference Proceedings
;
963
, 2
;
175-178
;
2007
- Article (Journal) / Electronic Resource
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Title:Ground State Energy Shift of He and Close to a Surface: A Confinement Model
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Contributors:Cruz, Salvador A. ( author ) / Ley‐Koo, Eugenio ( author ) / Cabrera‐Trujillo, Remigio ( author ) / Simos, Theodore E. ( editor ) / Maroulis, George ( editor )
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Published in:AIP Conference Proceedings ; 963, 2 ; 175-178
-
Publisher:
- New search for: American Institute of Physics
-
Publication date:2007-12-26
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Size:4 pages
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ISSN:
-
DOI:
-
Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 963, Issue 2
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 3
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The Rodney Bartlett Honor SymposiumMaroulis, George / Thakkar, Ajit J. / Murakami, K. J. et al. | 2007
- 6
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Utilizing the Fact that Among All Trial Functions Orthogonal to an Approximate Ground State, the closest, to the Exact First Excited State, has lower energy than the Exact:Bacalis, Naoum C. et al. | 2007
- 10
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Information‐Theoretic Biodescriptors for Proteomics Maps: Applications to Rodent HepatotoxicityBasak, Subhash C. / Gute, Brian D. / Geiss, Kevin T. / Witzmann, Frank A. et al. | 2007
- 14
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Modeling the IR Spectra of Acetaldehyde from a New Vibrational Configuration Interaction MethodBégué, Didier / Pouchan, Claude et al. | 2007
- 19
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Stability and Structure of ClustersDhiflaoui, J. / Bouzouita, H. / Berriche, H. et al. | 2007
- 23
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Theoretical Study of the CsLi Molecule Beyond the Born‐Oppenheimer ApproximationMabrouk, N. / Berriche, H. / Gadea, F. X. et al. | 2007
- 28
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Similarity and Dissimilarity of DNA/RNA SequencesBielińska‐Wa̧ż, D. / Wa̧ż, P. / Nowak, W. / Nandy, A. / Basak, S. C. et al. | 2007
- 31
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Protein Dynamics and Spectroscopy for Ferryl Intermediate of Cytochrome c Oxidase: A Molecular Dynamics ApproachDaskalakis, Vangelis / Farantos, Stavros C. / Varotsis, Constantinos et al. | 2007
- 35
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Comparative Theoretical Study of Poly[3‐(4‐Octylphenyl)thiophenes] and Poly[3‐(4‐octylphenoxy)thiophenes] as Promising Photovoltaic Cells MaterialsDkhissi, Ahmed / Pouchan, Claude et al. | 2007
- 40
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SMMH—A Parallel Heuristic for Combinatorial Optimization ProblemsDomingues, Guilherme / Morie, Yoshiyuki / Gu, Feng Long / Nanri, Takeshi / Murakami, Kazuaki et al. | 2007
- 44
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Induced Hyper‐Rayleigh Spectra. Theoretical and Numerical Analysis of Spectral MomentsGłaz, Waldemar / Bancewicz, Tadeusz / Godet, Jean‐Luc / Maroulis, George et al. | 2007
- 48
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Reduced Density Matrices in Quantum Electronic TransportBartlett, R. J. / Fagas, G. / Greer, J. C. et al. | 2007
- 52
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Investigating the Performance of Collective Communications on SMP Clusters: A Case for MPI_AllgatherGu, Feng Long / Nzigou M., Hyacinthe / de Melo Baptista Domingues, Guilherme / Nanri, Takeshi / Murakami, Kazuaki et al. | 2007
- 57
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Cp‐curve, a Novel 3‐D Graphical Representation of ProteinsBai, Haihua / Li, Chun / Agula, Hasi / Jirimutu / Wang, Jun / Xing, Lili et al. | 2007
- 61
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Are There Frame‐Distortion Contributions to Collision‐Induced Absorption and Collision‐Induced Light Scattering?Hohm, Uwe et al. | 2007
- 64
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Implementation and Evaluation of Fock Matrix Calculation Program on the Cell ProcessorHonda, Hiroaki / Hayashi, Tetsuo / Inadomi, Yuichi / Inoue, Koji / Murakami, Kazuaki J. et al. | 2007
- 68
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Electric Dipole Polarizability of Aluminum Phosphide Clusters and Electron DelocalizationKaramanis, Panaghiotis / Xenides, Demetrios et al. | 2007
- 72
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Computational Studies on Dihalogen Complexes of N‐methyl Imidazoline‐2‐thione and N‐methyl Imidazolidine‐2‐thioneKosmas, Agnie Mylona / Papayannis, Demetrios K. et al. | 2007
- 76
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Halogenated Methyl Nitrates, ( Cl). A Computational Study of their Properties and Capacity to Act as Sink Compounds in the TroposphereKosmas, Agnie M. / Lesar, Antonija et al. | 2007
- 80
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Field‐Theoretical Approach to Many‐Body Perturbation Theory: Combining MBPT and QEDLindgren, Ingvar / Salomonson, Sten / Hedendahl, Daniel et al. | 2007
- 84
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Improvements in Algorithms for Two Electron Repulsion Integrals Evaluation in Gaussian Type Basis SetsMakowski, Marcin et al. | 2007
- 88
-
Phenomenological and Microscopic Description of Molecular Layer and Crystal Optical PolarizationMestechkin, M. et al. | 2007
- 92
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The rôle of Metals in Amyloid Aggregation: A Test Case for ab initio SimulationsMinicozzi, V. / Morante, S. / Rossi, G. C. / Stellato, F. et al. | 2007
- 98
-
EOM‐CCSDT Study of the Low‐Lying Ionization Potentials of and OCSMusiał, Monika et al. | 2007
- 102
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Second Hyperpolarizabilities (γ) of 1,3‐Dipole Systems: Diradical Character Dependence of γNakano, Masayoshi / Kishi, Ryohei / Takebe, Akihito / Nate, Masahito / Takahashi, Hideaki / Kubo, Takashi / Kamada, Kenji / Ohta, Koji / Champagne, Benoît / Botek, Edith et al. | 2007
- 106
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Evaluation of the Performance of Parallel Sparse‐Matrix Multiplication and the Effect of Dynamic Load‐BalancingNanri, Takeshi / Soga, Takeshi / Kurihara, Koji / Gu, Feng Long / Ishihata, Hiroaki / Murakami, Kazuaki et al. | 2007
- 110
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Vibrational Normal Modes Contributions to the Vibrational First Hyperpolarizability in a Sample of TICT Molecules.Saal, Amar / Ben Ali, Mahfoud Hadj / Ouamerali, Ourida et al. | 2007
- 114
-
Predictive Quantum Chemistry: A Step Toward “Chemistry Without Test Tubes”Perera, Ajith et al. | 2007
- 118
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Band Structure of Polymer Extracted from Oligomer CalculationsPomogaeva, Anna / Gu, Feng Long / Kirtman, Bernard / Aoki, Yuriko et al. | 2007
- 122
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Multi‐physics Extension of OpenFMO FrameworkTakami, Toshiya / Maki, Jun / Ooba, Jun'ichi / Inadomi, Yuuichi / Honda, Hiroaki / Susukita, Ryutaro / Inoue, Koji / Kobayashi, Taizo / Nogita, Rie / Aoyagi, Mutsumi et al. | 2007
- 126
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ΛCCSD(T) Energies and Forces: Improving Upon CCSD(T)Taube, Andrew G. / Bartlett, Rodney J. et al. | 2007
- 130
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Implementation of CCNUGrid‐based Computational Environment for Molecular ModelingLiu, Kai / Luo, Changhua / Ren, Yanliang / Wan, Jian / Xu, Xin et al. | 2007
- 137
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The Nils Yngve Öhrn SymposiumHarris, Frank E. / Sabin, John R. et al. | 2007
- 138
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On A Dynamic Career: A Tribute To Nils Yngve ÖhrnHarris, Frank E. / Sabin, John R. et al. | 2007
- 147
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Quantum Chemistry and Non‐Equilibrium Thermodynamics: Does Chaos Play a Role in Quantum Chemical Calculations?André, J.‐M. / André, M.‐Cl. / Fripiat, J. G. / Lambert, C. et al. | 2007
- 151
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Molecular Photoionization Cross‐Sections by Application of Stieltjes Imaging to Lanczos PseudospectraGokhberg, K. / Averbukh, V. / Vysotskiy, V. / Cederbaum, L. S. et al. | 2007
- 155
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New Directions in Floating‐Point ArithmeticBeebe, Nelson H. F. et al. | 2007
- 159
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Relativity and Quantum MechanicsBrändas, Erkki J. et al. | 2007
- 163
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Many‐Electron Bands in Transition Metal CompoundsStoyanova, A. / de Graaf, C. / Broer, R. et al. | 2007
- 167
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Computing Oscillator Strengths and Related PropertiesChampagne, Benoît et al. | 2007
- 171
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The Hartree‐Fock‐Heitler‐London Method with Applications to First and Second Row Diatomic Hydrides and Homopolar MoleculesCorongiu, Giorgina / Clementi, Enrico et al. | 2007
- 175
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Ground State Energy Shift of He and Close to a Surface: A Confinement ModelCruz, Salvador A. / Ley‐Koo, Eugenio / Cabrera‐Trujillo, Remigio et al. | 2007
- 179
-
Fourier Representation Methods for Mo/ller‐Plesset Perturbation Theory in One‐Dimensionally Periodic SystemsFripiat, J. G. / Delhalle, J. / Harris, Frank E. et al. | 2007
- 183
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Optimized Basis Sets for Calculating Spin‐Spin Coupling ConstantsBenedikt, Udo / Auer, Alexander A. / Jensen, Frank et al. | 2007
- 187
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Explicit Electron Correlation by a Combined Use of Gaussian‐Type Orbitals and Gaussian‐Type GeminalsDahle, Pål / Helgaker, Trygve / Jonsson, Dan / Taylor, Peter R. et al. | 2007
- 191
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Can Electron Propagator Methods Be Used To Improve Polarization Propagator Methods?Jo/rgen, Hans / Jensen, Aagaard et al. | 2007
- 193
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Trial Wavefunctions for Quantum Monte Carlo Simulations with Numerically Stable Analytical Gradients over Exponential Type OrbitalsHoggan, Philip E. et al. | 2007
- 197
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Three Quantum Leaps in the Development of Information SecurityKaijser, Per et al. | 2007
- 200
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Vector Potential Approach for Response of Infinite Periodic Systems to Electric FieldsKirtman, Bernard / Springborg, Michael et al. | 2007
- 206
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The Concept of Molecular Shape Response Quantified within Force Field ApproachKarpfen, Alfred / Kryachko, Eugene S. et al. | 2007
- 210
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Recent Developments in Quantum Monte Carlo: Methods and ApplicationsAspuru‐Guzik, Alan / Austin, Brian / Domin, Dominik / Galek, Peter T. A. / Handy, Nicholas / Prasad, Rajendra / Salomon‐Ferrer, Romelia / Umezawa, Naoto / Lester, William A. et al. | 2007
- 212
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The Science of Yngve ÖhrnLinderberg, Jan et al. | 2007
- 216
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Chirped Pulse Adiabatic Passage in CARS for Imaging of Biological Structure and DynamicsMalinovskaya, Svetlana A. et al. | 2007
- 219
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First Principles Dynamics of Photoexcited DNA and RNA BasesHudock, Hanneli R. / Levine, Benjamin G. / Thompson, Alexis L. / Martinez, Todd J. et al. | 2007
- 223
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Two‐Photon Cross‐Sections of Photosensitizers in Vacuum, in Solution and within ProteinsRehman, M. / Olsen, L. / Mikkelsen, K. V. et al. | 2007
- 227
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Local Complex Potential Based Time Dependent Wave Packet Approach to Calculation of Vibrational Excitation Cross‐sections in and e‐CO ScatteringSarma, Manabendra / Singh, Raman K. / Mishra, Manoj K. et al. | 2007
- 231
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Accurate Dissociation Energies of and Calculated by MRCI MethodMitin, Alexander V. et al. | 2007
- 235
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Non‐Adiabatic Effects in Electron Tunneling in Molecular JunctionsMujica, Vladimiro / Hansen, Thorsten / Ratner, Mark A. et al. | 2007
- 238
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Electron Propagator Theory and the Development of Chemical IntuitionOrtiz, J. V. et al. | 2007
- 241
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Quasiparticle and Optical Excitations in Solid Ne and Ar: GW and BSE ApproximationsPatterson, Charles H. / Galamić‐Mulaomerović, S. et al. | 2007
- 245
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Recent Results in Quantum Chemical Kinetics from High Resolution SpectroscopyQuack, Martin et al. | 2007
- 249
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Why Does Controlling Quantum Phenomena Appear Easy to Achieve?Rabitz, Herschel et al. | 2007
- 252
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Response to Geometric Distortions from Atom‐Based Relativistic Projection on Electronic StatesMatveev, Alexei V. / Rösch, Notker et al. | 2007
- 256
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How Do Low‐energy (0.1–2 eV) Electrons Cause DNA Strand Breaks?Simons, Jack et al. | 2007
- 260
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Enormous Isotope Effects on Charge Transfer in Slow Collisions of with H, D, and TStolterfoht, N. / Cabrera‐Trujillo, R. / Öhrn, Y. / Deumens, E. / Hoekstra, R. / Sabin, J. R. et al. | 2007
- 264
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Limitations of Racah‐Wigner Algebra in ‐Invariant Theoretic Modelling of NMR Spin Dynamics via Dual Tensorial SetsTemme, F. P. et al. | 2007
- 269
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Cross Sections for and Production in the Collision of Ions with Atomic HeGonzález, Olmo / Combes, Manuel / Gleason, Cristian / Hinojosa, G. / Cabrera‐Trujillo, R. et al. | 2007
- 274
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Electron‐Correlation Effects in Metals from First Principles: a Multi‐Reference Incremental SchemeVoloshina, Elena / Paulus, Beate et al. | 2007
- 278
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Long‐Distance Electron Transfer Coupled to Proton Pumping and Energy Transduction in Biological Systems: A Semiempirical First‐Principles ApproachZheng, Xuehe / Ly, Ngan M. / Stuchebrukhov, Alexei A. et al. | 2007
- 285
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Multi‐Scale Simulations For Materials and Life SciencesCastet, Frédéric / Champagne, Benoît / Nakano, Masayoshi / Takahashi, Hideaki et al. | 2007
- 287
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Density Functional Theory Investigation of Eu(III) Complexes for Fluorescence CompoundsAiga, Fumihiko / Iwanaga, Hiroki / Amano, Akio et al. | 2007
- 291
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Approaches to Dealing with High‐Sized Polynuclear Systems with ab initio MethodsCalzado, Carmen J. / Malrieu, Jean‐Paul / Maynau, Daniel et al. | 2007
- 295
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A Valence Bond Model to Evaluate Electronic Parameters for Charge Transport in Organic AggregatesAurel, Philippe / Fritsch, Alain / Ducasse, Laurent / Linares, Mathieu / Cornil, Jérôme / Beljonne, David / Castet, Frédéric et al. | 2007
- 299
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Through‐bond Versus Through‐Space Contributions on Excitation Energy Transfer in Condensed PhaseCurutchet, Carles / Russo, Vincenzo / Mennucci, Benedetta et al. | 2007
- 303
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Applied Quantum Chemistry to Design AntibioticsDive, Georges / Dehareng, Dominique et al. | 2007
- 306
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Photochemistry of Organic Light‐Emitting DiodesEhara, Masahiro / Nakatsuji, Hiroshi et al. | 2007
- 311
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Structure‐based Drug Screening and Ligand‐Based Drug Screening Toward Protein‐Compound NetworkFukunishi, Yoshifumi et al. | 2007
- 315
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QMMM Methods for the Spin Density in Heme Compound IGuallar, Victor et al. | 2007
- 318
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Nonlinear Optical Properties of Conjugated Molecules Studied by Time‐Dependent Density Functional TheoryGuthmuller, J. / Simon, D. et al. | 2007
- 322
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Theoretical Studies on Docking Dynamics and Electronic Structure in Metalloprotein ComplexesSugiyama, Ayumu / Nishikawa, Keigo / Yamamoto, Tetsunori / Purqon, Acep / Nishikawa, Kiyoshi / Nagao, Hidemi et al. | 2007
- 326
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Ab Initio HF and DFT Calculation of the Second Order NLO Response of Tetrathiafulvalene and 1,3‐Dithiole DerivativesAndreu, R. / Blesa, M. J. / Franco, S. / Garín, J. / Orduna, J. et al. | 2007
- 330
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Treatment of Vibronic Interactions Using Variational Methods for Nuclear MotionLuis, Josep M. / Torrent‐Sucarrat, Miquel / Christiansen, Ove / Kirtman, Bernard et al. | 2007
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Geometry Optimization without Spin Contamination Error ‐ Approximately Spin Projected Optimization Method ‐Kitagawa, Y. / Saito, T. / Nakanishi, Y. / Ito, M. / Shoji, M. / Koizumi, K. / Yamanaka, S. / Kawakami, T. / Okumura, M. / Yamaguchi, K. et al. | 2007
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Ab initio Study of Ultrafast Photochemical Ring‐Opening Reaction of 1,3‐CyclohexadieneKobayashi, Takao / Shiga, Motoyuki / Murakami, Akinori / Nakamura, Shinichiro et al. | 2007
- 342
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Free Energy of Solvation in the Energetic PerspectiveMatubayasi, Nobuyuki et al. | 2007
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How the Molecular Environment Controls Excitation Energy Transfer and Light Harvesting: a Quantum Mechanical ModelMennucci, Benedetta / Curutchet, Carles / Cammi, Roberto / Scholes, Gregory D. et al. | 2007
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Theoretical Methods for Structured EnvironmentsMikkelsen, Kurt V. et al. | 2007
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Symposium 2 PrefaceZdetsis, Aristides et al. | 2007
- 359
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Codoping goes Nano: Structural and Optical Properties of Boron and Phosphorus Codoped Silicon NanocrystalsMagri, Rita / Iori, F. / Degoli, E. / Pulci, O. / Ossicini, S. et al. | 2007
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Ab‐initio Investigations of Surface Electronic Structure and Metal‐Hydrogen Interaction in Titanium‐ and Palladium‐Based AlloysKulkova, Svetlana E. / Kulkov, Sergey S. / Eremeev, Sergey V. / Bazhanov, Dmitry I. et al. | 2007
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Theoretical Study of Sulphur Interaction with CeriaBaranek, Ph. / Gauthier, L. / Marrony, M. et al. | 2007
- 371
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Electronic Structure and Vibrational Spectra of MagnetitePatterson, Charles H. / Rowan, Andrew D. et al. | 2007
- 375
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High‐stability Finite‐Length Silicon Nanowires: A Real Space Theoretical StudyKoukaras, E. N. / Zdetsis, A. D. / Garoufalis, C. S. et al. | 2007
- 379
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Pressure Driven Phase Transitions of Ferroelectric A Hybrid Functional Approach.Baranek, Ph. et al. | 2007
- 383
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Is Aromaticity and Fluxionality the Key to Magicity of Cluster?Zdetsis, Aristides D. et al. | 2007
- 387
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Investigation of the Electronic Structure and Magnetic Properties of Heusler Half‐Metallic Alloys at Surfaces and InterfacesEremeev, S. V. / Kulkova, S. E. / Smolin, I. Yu. et al. | 2007
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Raman and infrared vibrational properties of the protonic defect in the Ce) perovskites: a quantum mechanical study of protonic diffusion mechanismsBaranek, Ph. / Marrony, M. et al. | 2007
- 395
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Electronic and Structural Properties of and Clusters, ZnKoukaras, Emmanuel N. / Zdetsis, Aristides D. et al. | 2007
- 401
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Symposium 3: Computational Methods in Chemical Engineering: Physical ChemistryBitsanis, Ioannis A. / Manias, Evangelos et al. | 2007
- 404
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Modeling the Viscosity of Aluminosilicate MeltsDecterov, Sergei A. / Grundy, A. Nicholas / Jung, In‐Ho / Pelton, Arthur D. et al. | 2007
- 408
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Molecular Modeling of Polydimethylsiloxane MixturesMakrodimitri, Zoi A. / Economou, Ioannis G. et al. | 2007
- 412
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Physico‐chemical Characteristics of Thermopylae Natural Hot Water Springs in Central Greece: Chemical GeothermometryVerros, G. D. / Latsos, T. / Anagnostou, K. E. / Avlakiotis, P. / Chaikalis, C. / Liolios, C. / Antoniou, D. / Kotsopoulos, S. / Arsenos, P. et al. | 2007
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Computer Design of Copolymers with Desired Functionalities: Microphase Separation in Diblock Copolymers with Amphiphilic BlockKhokhlov, Alexei R. / Kriksin, Yury A. / Erukhimovich, Igor Ya. / Khalatur, Pavel G. et al. | 2007
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Conformational Properties of Dendritic Homopolymers with Interacting Branching PointsEfthymiopoulos, Pavlos / Kosmas, Marios et al. | 2007
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Conformational Transitions of a Model Polymeric System near Attractive Surfaces: a Monte Carlo StudyRissanou, A. N. / Anastasiadis, S. H. / Bitsanis, I. A. et al. | 2007
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Odd Electrons of Nanomaterials: A New Approach to Computational Chemical EngineeringSheka, Elena F. et al. | 2007
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Theoretical Study of Adsorption of Star‐Polymers by Mean Field TheoryKritikos, Georgios / Terzis, Andreas F. et al. | 2007
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On the Validity of the Geometric Rule in Multi‐component DiffusionVerros, George D. et al. | 2007
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Phase Equilibrium of Colloid Systems with Particle Size Dispersity: A Monte Carlo StudyYiannourakou, Marianna / Bitsanis, Ioannis / Economou, Ioannis et al. | 2007
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Computational Modelling of Amperometric Enzyme Electrodes with Selective and Perforated MembranesBaronas, Romas / Ivanauskas, Feliksas / Kulys, Juozas et al. | 2007
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Quantum Chemical Study of Anion Adsorption on Low‐Index Faces of Cu, Ag and Au from Aqueous SolutionsNechaev, I. / Vvedenskii, A. / Grushevskaya, S. et al. | 2007
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Electronic Structure of Five‐Atomic Thickness Cu, Ag, Au and Pd Films with Adsorbed Chloride AnionNechaev, I. / Sokova, V. / Vvedenskii, A. / Grushevskaya, S. et al. | 2007
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Use of Factor Analysis in Multi‐Electron SpectroelectrochemistryRyan, Michael D. / Keesey, Robert L. et al. | 2007
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Numerical Simulation of Mass Transport in Electrochemical Systems Based on the Mean Spherical ApproximationVan Damme, S. / Deconinck, J. et al. | 2007
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Preface of the 5th Symposium on Mathematical ChemistryNikolić, Sonja et al. | 2007
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Hierarchical Policy Model for Managing Heterogeneous Security SystemsLee, Dong‐Young / Kim, Minsoo et al. | 2007
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RFID Based Context Information Security System Architecture for Securing Personal Information under Ubiquitous EnvironmentSong, Jae‐Gu / Park, Gil‐Cheol / Kim, Seoksoo et al. | 2007
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A Study on the RFID Tag Encryption using Fast SEEDKo, Hoon / Kim, Jiyeon / Jung, Jongjin / Joe, Susan / Lee, Yongjun / Chang, Yoonseok et al. | 2007
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Multiple Object Based RFID System Using Security LevelKim, Jiyeon / Jung, Jongjin / Ryu, Ukjae / Ko, Hoon / Joe, Susan / Lee, Yongjun / Kim, Boyeon / Chang, Yunseok / Lee, Kyoonha et al. | 2007
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- 586
-
Benign and Degrading Excited‐State Processes of DNA Nucleobases and their DerivativesBlancafort, Lluís / Asturiol, David / Migani, Annapaola / Kobyłecka, Monika / Rak, Janusz et al. | 2007
- 589
-
Molecular Structure and Function Probed by High‐Resolution SpectroscopyBuma, Wybren Jan / de Groot, Mattijs / Rijs, Anouk M. et al. | 2007
- 593
-
Molecular Simulation Studies of Proteins Involved in Parkinson's DiseaseCarloni, Paolo et al. | 2007
- 594
-
The Role of Intersection Space Segments in Photochemical ReactionsCastaño, Obis / Sancho, Unai / Garavelli, Marco / Olivucci, Massimo / Frutos, Luis Manuel et al. | 2007
- 598
-
Protein Conformational Plasticity: the “off‐on” Switching Movement in Cdk5Cavalli, Andrea / Berteotti, Anna / Branduardi, Davide / Gervasio, Francesco L. / Recanatini, Maurizio / Parrinello, Michele et al. | 2007
- 599
-
The Calculation of the Correlation Energy in Ground and Excited States: the n–Electron Valence State Perturbation Theory ApproachCimiraglia, Renzo / Angeli, Celestino et al. | 2007
- 603
-
Artificial Molecular Devices and Machines Driven by LightSemeraro, Monica / Silvi, Serena / Credi, Alberto et al. | 2007
- 607
-
Vertical Singlet Excitations on Adenine Dimer: A Time Dependent Density Functional StudyCrespo‐Hernández, Carlos E. / Marai, Christopher N. J. et al. | 2007
- 611
-
Agile Modelling of Cellular SignallingDanos, Vincent et al. | 2007
- 615
-
Kinetic and Spectroscopic Investigations by Ultrafast Absorption and Emission TechniquesElisei, Fausto / Barbafina, Arianna / Carlotti, Benedetta / Latterini, Loredana et al. | 2007
- 619
-
Reachability Analysis of Biological Signalling Pathways by Abstract InterpretationFeret, Jérôme et al. | 2007
- 623
-
New Computational Approaches in the Study of Nonvertical Triplet Energy TransferManuel Frutos, Luis / Ulises Acuña, A. / Castaño, Obis et al. | 2007
- 627
-
Branching and Momentum Effects in PhotochemistryFuß, Werner et al. | 2007
- 631
-
Towards the Understanding of the Excited State Dynamics of Nucleic Acids: Solvent and Stacking Effect on the Photophysical Behavior of NucleobasesSantoro, Fabrizio / Gustavsson, T. / Lami, Sandro / Barone, Vincenzo / Improta, Roberto et al. | 2007
- 635
-
The Determinant of Light‐Energy and Light‐Signal Conversion in RhodopsinsKandori, Hideki et al. | 2007
- 638
-
An Exact and Scalable Stochastic Simulation Algorithm.Krivine, Jean et al. | 2007
- 642
-
A Calculus for Modelling, Simulating and Analysing Compartmentalized Biological SystemsMardare, Radu / Ihekwaba, Adaoha et al. | 2007
- 647
-
Functional Molecular Materials: Modelling Structure, Optical Properties, Intermolecular Interactions.Negri, Fabrizia et al. | 2007
- 651
-
Structural Order in Water: Comparison between the Spectral Analysis of Raman Data and Molecular Dynamics ResultsFaginas Lago, N. / Paolantoni, M. / Laganá, A. / Alberti, M. et al. | 2007
- 655
-
An ab initio Study of Decay Mechanism of Adenine: the Facile Path of the Amino NH Bond CleavageConti, Irene / Garavelli, Marco / Orlandi, Giorgio et al. | 2007
- 659
-
Iridium Complexes with Terdentate Ligands: Cyclometalated vs. Polypyridine Analogues; Hybrid vs. “Pure” DFTRavaglia, Marcella / Garavelli, Marco / Polson, Matthew / Scandola, Franco et al. | 2007
- 663
-
Primary Events in Retinal Proteins Revealed by Ultrafast SpectroscopyBismuth, O. / Kahan, A. / Friedman, N. / Sheves, M. / Ruhman, S. et al. | 2007
- 667
-
Quantum Dynamics of Ultrafast Photoinduced Processes in Biological MoleculesSantoro, Fabrizio / Barone, Vincenzo / Improta, Roberto / Lami, Alessandro / Olivucci, Massimo et al. | 2007
- 671
-
FTIR Studies of Internal Water Molecules of Bacteriorhodopsin: Structural Analysis of Halide‐bound D85S and D212N Mutants in the Schiff Base RegionShibata, Mikihiro / Kandori, Hideki et al. | 2007
- 674
-
Flavin Charge Transfer Transitions Assist DNA Photolyase Electron TransferSkourtis, Spiros S. / Prytkova, Tatiana / Beratan, David N. et al. | 2007
- 678
-
Protein Induced Torsion of the Retinal Chromophore and How it Affects the Photochemistry of RhopdopsinWeingart, Oliver / Buss, Volker et al. | 2007
- 681
-
Compositional vs. Monolithical Modeling of Nano DevicesZavattaro, Gianluigi et al. | 2007
- 685
-
COBRAMM (part 1): a Tunable QM/MM Approach to Chemical Reactivity, Structure and Physico‐Chemical Properties PredictionAltoè, Piero / Stenta, Marco / Bottoni, Andrea / Garavelli, Marco et al. | 2007
- 689
-
Rhodopsin and GFP Chromophores: QM/MM Absorption Spectra in Solvent and ProteinAltoè, Piero / Stenta, Marco / Garavelli, Marco et al. | 2007
- 693
-
The CIS‐TRANS Photoisomerization of the PhytochromobilinDe Fusco, Giulia C. / Altoè, Piero / Garavelli, Marco et al. | 2007
- 696
-
Computational QM/MM Study of the Reaction Mechanism of Human Glutathione S‐Transferase A3‐3Calvaresi, Matteo / Stenta, Marco / Altoè, Piero / Bottoni, Andrea / Garavelli, Marco / Spinelli, Domenico et al. | 2007
- 699
-
Azobenzene cis‐trans Photoisomerization Mechanism: Characterization of the Decay Ways from the Lowest Absorbing Singlet StateConti, Irene / Garavelli, Marco / Orlandi, Giorgio et al. | 2007
- 703
-
Heteroaromatic Chromophores: Structure, Electric Properties, Condensed Phase and Aggregation Effects: a Combined Experimental and Theoretical StudyElli, Stefano / Magrì, Andrea / Venturini, Elisa / Negri, Fabrizia / Abbotto, Alessandro / Bellotto, Luca / Painelli, Anna / Sissa, Cristina / Terenziani, Francesca et al. | 2007
- 706
-
Ultrafast Electron Transfer in Photosynthesis: Reduced Pheophytin and Quinone Interaction Mediated by Conical IntersectionsOlaso‐González, Gloria / Merchán, Manuela / Serrano‐Andrés, Luis et al. | 2007
- 710
-
Toward an Understanding of the Spectral Tuning in RhodopsinOlaso‐González, Gloria / Tomasello, Gaia / Altoè, Piero / Stenta, Marco / Serrano‐Andrés, Luis / Merchán, Manuela / Garavelli, Marco et al. | 2007
- 713
-
Three‐layer ONIOM Studies of Rhodopsin in the Dark State: Shedding Light on the Protonation State of Glu‐181Hall, Katherine F. / Vreven, Thom / Frisch, Michael J. / Bearpark, Michael J. et al. | 2007
- 714
-
COBRAMM (part 2): an Overview on Some Computational Details; Geometry Optimization, Frequency Calculation, Analysis of the ResultsStenta, Marco / Altoè, Piero / Bottoni, Andrea / Garavelli, Marco et al. | 2007
- 717
-
The Catalytic Activity of Diaminopimelate Epimerase: a QM/MM StudyStenta, Marco / Calvaresi, Matteo / Altoè, Piero / Spinelli, Domenico / Garavelli, Marco / Bottoni, Andrea et al. | 2007
- 720
-
The Catalytic Activity of Proline Racemase: a QM/MM StudyStenta, Marco / Calvaresi, Matteo / Altoè, Piero / Spinelli, Domenico / Garavelli, Marco / Bottoni, Andrea et al. | 2007
- 724
-
Ab initio Investigation to Model Stilbene Photo‐Physical Properties by Combining CC2 Topological Investigation and CASPT2 Energy CorrectionsTomasello, Gaia / Altoè, Piero / Garavelli, Marco / Orlandi, Giorgio et al. | 2007
- 727
-
Retinal Photoisomerization in Rhodopsin: Electrostatic and Steric CatalysisTomasello, Gaia / Altoè, Piero / Stenta, Marco / Olaso‐González, Gloria / Garavelli, Marco / Orlandi, Giorgio et al. | 2007
- 733
-
Preface: Quantum Control and Light‐Matter Interactions: Recent Computational and Theoretical ResultsPaspalakis, Emmanuel / Thanopulos, Ioannis et al. | 2007
- 736
-
Implementing Universal Quantum Gates in Coupled CavitiesAngelakis, Dimitris G. / Kay, Alastair et al. | 2007
- 740
-
Quantum Control and Entanglement of Two Electrons in a Double Quantum Dot StructureBoviatsis, John / Voutsinas, Evangelos et al. | 2007
- 744
-
Quantum Phase Transitions in Coupled Arrays of CavitiesBrandão, F. G. S. L. / Hartmann, M. J. / Plenio, M. B. et al. | 2007
- 748
-
A Simple Control Switch Model for Quantum ComputationChatzisavvas, K. Ch. / Daskaloyannis, C. / Schirmer, S. G. et al. | 2007
- 752
-
The Study of the Nuclear Motion in Molecular Ion By Using the Harmonic SpectraDaniele, R. / Castiglia, G. / Corso, P. P. / Fiordilino, E. / Morales, F. / Orlando, G. / Persico, F. et al. | 2007
- 756
-
Quantum Control of Interacting Multiatom SystemsEvers, Jörg / Kiffner, Martin / Keitel, Christoph H. et al. | 2007
- 760
-
Cavity QED Schemes for Controlled Creation of Entanglement Between Distant AtomsFicek, Zbigniew et al. | 2007
- 764
-
Dressed rf trappingGarraway, Barry M. et al. | 2007
- 768
-
Coherent Control of Extreme Nonlinear Optical Properties of Quantum System via Ultrashort Laser PulsesGong, Shangqing / Xia, Keyu / Niu, Yueping et al. | 2007
- 772
-
Control of Atomic and Molecular Processes by Designed External Fields: From Adiabatic to Ultrashort Pulse StrategiesGuérin, S. et al. | 2007
- 777
-
Electronic Structure of Few‐Electron Quantum Dot MoleculesPopsueva, V. / Hansen, J. P. / Caillat, J. et al. | 2007
- 781
-
Controllable Atom Localization in Four‐Level Atomic SystemsJin, Luling / Jin, Shiqi / Gong, Shangqing et al. | 2007
- 785
-
Implementation of a Hadamard Gate Using Laser Light on a Phosphorus Doped Si DeviceNtalaperas, D. / Konofaos, N. et al. | 2007
- 788
-
Parametric Four‐Wave Mixing in Low Atomic Densities of Potassium VaporPentaris, D. / Merlemis, N. / Lyras, A. / Efthimiopoulos, T. et al. | 2007
- 792
-
Fast Cooling of Trapped Ions Using the Dynamical Stark ShiftRetzker, A. / Plenio, M. B. et al. | 2007
- 796
-
Implementation of Quantum Gates via Optimal Control in the Presence of Cross‐talkSchirmer, Sonia G. / Kandasamy, Gajendran / Hollenberg, Lloyd C. L. et al. | 2007
- 801
-
Optimal Bichromatic Two‐Photon Excitation with Near‐Resonant Chirped PulsesSerrat, Carles / Biegert, Jens et al. | 2007
- 805
-
Simulations of Dipole‐Dipole Interaction in Nonlinear Photonic Crystals Doped With NanoparticlesSingh, Mahi R. et al. | 2007
- 809
-
A Molecular Double Slit ParadigmSkourtis, Spiros S. / Beratan, David N. et al. | 2007
- 813
-
Quantum Control of Molecular PropertiesSola, I. R. / González‐Vázquez, J. / Santamaria, J. / Malinovsky, V. S. / Chang, B. Y. et al. | 2007
- 817
-
Large Self‐ and Cross‐Phase Modulations via Fano Interference in Asymmetric Quantum WellsSun, Hui / Niu, Yueping / Gong, Shangqing et al. | 2007
- 821
-
Analytic Approach for Controlling Realistic Quantum Chaotic SystemsTakami, Toshiya / Fujisaki, Hiroshi et al. | 2007
- 825
-
Controlled Population Transfer in a Double Quantum Dot SystemFountoulakis, Antonios / Terzis, Andreas F. / Paspalakis, Emmanuel et al. | 2007
- 829
-
Temporal Compression of Laser Pulses by Coherent ControlTognetti, M. V. / Buffa, R. / Cavalieri, S. / Fini, L. / Ignesti, E. / Sali, E. et al. | 2007
- 832
-
Synthesis of Arbitrary Unitary Transformations in Quantum Systems by Householder ReflectionsIvanov, P. A. / Vitanov, N. V. et al. | 2007
- 836
-
Initial Conditions Effects in the Population Dynamics of a Driven Semiconductor Quantum Well StructureVoutsinas, Evangelos / Boviatsis, John et al. | 2007
- 840
-
Quantum Control Using Diabatic and Adiabatic TransitionsWisniacki, D. A. / Murgida, G. E. / Tamborenea, P. I. et al. | 2007
- 843
-
Laser Control of Photoassociation in ReactionNishikawa, Kiyoshi / Sugimori, Kimikazu / Nagao, Hidemi et al. | 2007
- 849
-
4th Symposium on Industrial and Environmental Case StudiesBatzias, Fragiskos et al. | 2007
- 851
-
Using GIS and Fuzzy Logic for Wastewater Treatment Processes Site Selection: The Case of Rodopi PrefectureAnagnostopoulos, K. P. / Vavatsikos, A. P. et al. | 2007
- 856
-
Fuzzy Multicriteria Ranking of Aluminium Coating MethodsBatzias, A. F. et al. | 2007
- 862
-
Analyte In Situ Processing at Micro‐Scale for Enhancing Biosensor Functionality—A New Taxonomic/Partonomic ApproachBatzias, D. F. / Sidiras, D. K. et al. | 2007
- 868
-
A Methodological Framework for Determining Optimal Dopant Density in a Biosensor TransducerBatzias, D. F. / Tsakiri, V. / Sidiras, D. K. et al. | 2007
- 874
-
Chemometric Tools in Environmental Data AnalysisReczynski, Witold / Jakubowska, Malgorzata / Bas, Boguslaw / Niewiara, Ewa / Kubiak, Władysław W. et al. | 2007
- 878
-
A Knowledge Based System Offering Consultation for Enhancing Semi‐Natural Wetland FunctionalityBatzias, A. F. / Efthymiadou, A. P. / Siontorou, C. G. et al. | 2007
- 884
-
Synthesizing Equivalence Indices for the Comparative Evaluation of Technoeconomic Efficiency of Industrial Processes at the Design/Re‐engineering LevelFotilas, P. / Batzias, A. F. et al. | 2007
- 890
-
Rehabilitation of Seven (7) Hydrocarbon Contaminated Sites in a Brackish Water/Lagoon Environment in South TrinidadMohammed, Avryl / Ramnath, Kelvin / Dyal, Shyam / Lalla, Francesca / Roopchand, Jaipersad et al. | 2007
- 894
-
Determining Capital Cost in Wastewater Treatment Installations Operating Under Inflow Characteristics UncertaintyBatzias, D. F. / Pollalis, Y. A. et al. | 2007
- 903
-
Computational Methods for the Liquid StateRode, B. M. / Hofer, T. S. et al. | 2007
- 904
-
Coupling MD Simulations and X‐ray Absorption Spectroscopy to Study Ions in SolutionMarcos, E. Sánchez / Beret, E. C. / Martínez, J. M. / Pappalardo, R. R. / Ayala, R. / Muñoz‐Páez, A. et al. | 2007
- 909
-
The Aquation of Po(IV): A Quantum Chemical Study.Ayala, R. / Martinez, J. M. / Pappalardo, R. R. / Munoz‐Paez, A. / Marcos, E. Sanchez et al. | 2007
- 913
-
Understanding of Drug‐Target Interactions: A case Study in Influenza Virus A Subtype H5N1Rungrotmongkol, Thanyada / Malaisree, Maturos / Decha, Panita / Laohpongspaisan, Chittima / Aruksakunwong, Ornjira / Intharathep, Pathumwadee / Pianwanit, Somsak / Sompornpisut, Pornthep / Parasuk, Vudhichai / Megnassan, Eugene et al. | 2007
- 917
-
Computational Challenges in Simulation Methods for Liquids and SolutionsHofer, Thomas S. / Randolf, Bernhard R. / Rode, Bernd M. et al. | 2007
- 921
-
Structure and Dynamics of Composite Anions in Aqueous SolutionPribil, Andreas B. / Vchirawongkwin, Viwat / Hofer, Thomas S. / Randolf, Bernhard R. et al. | 2007
- 924
-
Ab Initio QM/MM Simulations of Water and Hydrated CationsXenides, Demetrios / Randolf, Bernhard R. et al. | 2007
- 928
-
Preferential Solvation and Dynamics of Ions Solvated in Mixed Solvents: Insights from QM/MM MD Simulation ApproachTongraar, Anan / Rode, Bernd M. et al. | 2007
- 935
-
Preface of the Symposium 15: Cryptology, Information Security, and NetworksCaballero‐Gil, Pino / Meletiou, Gerasimos C. et al. | 2007
- 937
-
The Role of Priority Mechanisms on Performance Metrics of Double‐Buffered Switching ElementsVasiliadis, D. C. / Rizos, G. E. / Vassilakis, C. et al. | 2007
- 943
-
Evaluating the Multicast Control Protocol on a Multicasting Network ArchitectureStergiou, E. / Meletiou, G. / Vasiliadis, D. C. / Rizos, G. E. / Margariti, S. V. et al. | 2007
- 947
-
Multicasting in Wireless Communications (Ad‐Hoc Networks): Comparison against a Tree‐Based ApproachRizos, G. E. / Vasiliadis, D. C. et al. | 2007
- 954
-
Security Systems Consideration: A Total Security ApproachMargariti, S. V. / Meletiou, G. / Stergiou, E. / Vasiliadis, D. C. / Rizos, G. E. et al. | 2007
- 959
-
Security Issues in E‐learning SystemsTsiantis, L. E. / Stergiou, E. / Margariti, S. V. et al. | 2007
- 965
-
Stream Cipher Design for MANetsDelgado, Oscar / Fúster, Amparo et al. | 2007
- 969
-
Modeling Pseudorandom Sequence Generators using Cellular Automata: The Alternating Step GeneratorPazo‐Robles, María Eugenia / Fúster‐Sabater, Amparo et al. | 2007
- 973
-
New Directions in Online FraudMohatar, Oscar Delgado / Sierra Cámara, José M. et al. | 2007
- 979
-
International Symposium on Computational Electronics—Physical Modeling, Mathematical Theory, and Numerical AlgorithmLi, Yiming et al. | 2007
- 980
-
Signal Recognition by Nonparametric Discrimination of Functional Data for Vehicle Transportation SystemJou, Yow‐Jen / Lu, Yung‐Tsai / Lan, Chien‐Lun / Lee, Hsia et al. | 2007
- 984
-
Semi‐parametric Linear Mixed Effects Model for Vehicles IdentificationJou, Yow‐Jen / Yang, Chai‐Tzu / Huang, Chien‐Chia / Wu, Jennifer Yuh‐Jen et al. | 2007
- 989
-
Classification of Driving Behavior by Pattern Recognition in Multiclass Users Traffic FlowLo, Shih‐Ching et al. | 2007
- 993
-
A Circuit Simulation Technique for Congested Network Traffic Assignment ProblemCho, Hsun‐Jung / Huang, Heng et al. | 2007
- 997
-
High Frequency Property Optimization of Heterojunction Bipolar Transistors Using Geometric ProgrammingLi, Yiming / Chen, Ying‐Chieh et al. | 2007
- 1001
-
Numerical Simulation of Nanoscale Multiple‐Gate Devices Including Random Impurity EffectHwang, Chih‐Hong / Li, Yiming et al. | 2007
- 1005
-
A Passing Probability Model for Intelligent Transportation SystemCho, Hsun‐Jung / Li, Rih‐Jin et al. | 2007
- 1011
-
International Symposium on Technology Management: Modeling, Simulation, and OptimizationLi, Yiming et al. | 2007
- 1012
-
Exploring KM Features of High‐Performance CompaniesWu, Wei‐Wen et al. | 2007
- 1016
-
Efficiency Assessment of Road Project Delivery ModelsLo, Shih‐Ching / Chao, Yu et al. | 2007
- 1020
-
On Paradox of Transportation NetworksCho, Hsun‐Jung / Li, Yi‐Shan et al. | 2007
- 1024
-
A Hybrid Shortest Path Algorithm for Navigation SystemCho, Hsun‐Jung / Lan, Chien‐Lun et al. | 2007
- 1032
-
Modeling and Simulation of Bus Dispatching Policy for Timed Transfers on Signalized NetworksCho, Hsun‐Jung / Lin, Guey‐Shii et al. | 2007
- 1036
-
Modeling and Simulation of Multiphase Traffic FlowCho, Hsun‐Jung / Wu, Yuh‐Ting et al. | 2007
- 1040
-
A Comparative Study of Foreign Direct Investment Flow Using Diffusion ModelsLi, Yiming / Chiang, Yi‐Hui / Yu, Shao‐Ming / Chiang, Su‐Yun / Hung, C.‐H. et al. | 2007
- 1044
-
The Effect of Driving Behavior on Multiclass Users Traffic FlowLo, Shih‐Ching / Tsai, Hsiao‐Wei / Wang, Hsiao‐Huei / Chen, Mong‐Xi et al. | 2007
- 1051
-
Symposium on Business and Management and Dynamic Simulation Models Supporting Management StrategiesSakas, Damianos P. / Konstantopoulos, Nikolaos et al. | 2007
- 1054
-
Contribution of the Executives in Bank Sector Mergers: Application with a Simulation ModelSakas, Damianos P. / Konstantopoulos, Nikolaos / Triantafyllopoulos, Yiannis et al. | 2007
- 1058
-
Factors that Affect Synergies in Mergers, at Banking Sector: Simulation with a Dynamic ModelYiannis, Triantafyllopoulos / Sakas, Damianos P. / Konstantopoulos, Nikolaos et al. | 2007
- 1062
-
The Dimension of Communication in the Merger: Simulation with Dynamic ModelKonstantopoulos, Nikolaos / Sakas, Damianos P. / Triantafyllopoulos, Yiannis et al. | 2007
- 1066
-
Analyzing the Greek Marine Manpower in the Passenger and Cruise Markets Using System DynamicsAlexopoulos, A. B. / Konstantopoulos, Nikolaos et al. | 2007
- 1070
-
A Conceptual framework of Strategy, Structure and Innovative Behaviour for the Development of a Dynamic Simulation ModelKonstantopoulos, Nikolaos / Trivellas, Panagiotis / Reklitis, Panagiotis et al. | 2007
- 1074
-
A Dynamic Simulation Model of Organizational Culture and Business Strategy Effects on PerformanceTrivellas, Panagiotis / Reklitis, Panagiotis / Konstantopoulos, Nikolaos et al. | 2007
- 1078
-
Approaches to Cost Accounting in Tourist ManagementStella, Michail G. Bekiaris / Zounta, A. / Stavrinoudis, Theodoros A. et al. | 2007
- 1082
-
The Corporate Governance Framework & its Application to Privatizations of Public EnterprisesKenourgios, Dimitris / Samitas, Aristidis / Konstantopoulos, Nikolaos et al. | 2007
- 1086
-
A Simulation Model for Measuring Customer Satisfaction through Employee SatisfactionZondiros, Dimitris / Konstantopoulos, Nikolaos / Tomaras, Petros et al. | 2007
- 1090
-
A Dynamic Simulation Model of the Management Accounting Information Systems (MAIS)Konstantopoulos, Nikolaos / Bekiaris, Michail G. / Zounta, Stella et al. | 2007
- 1094
-
Organizational Strategy and Business Environment Effects Based on a Computation MethodReklitis, Panagiotis / Konstantopoulos, Nikolaos / Trivellas, Panagiotis et al. | 2007
- 1098
-
The Different Paths in the Franchising Entrepreneurship ChoiceTomaras, Petros / Konstantopoulos, Nikolaos / Zondiros, Dimitris et al. | 2007
- 1102
-
The Human Resource Management in Dry‐Bulk ShippingKonstantopoulos, Nikolaos / Alexopoulos, Aristotelis B. et al. | 2007
- 1106
-
The Values System in the Franchising EntrepreneurshipKonstantopoulos, Nikolaos / Tomaras, Petros / Zondiros, Dimitrios et al. | 2007
- 1110
-
Total Quality Management in Dry‐Bulk ShippingAlexopoulos, Aristotelis B. / Konstantopoulos, Nikolaos et al. | 2007
- 1117
-
Designing a Software Tool for Fuzzy Logic ProgrammingAbietar, José M. / Morcillo, Pedro J. / Moreno, Ginés et al. | 2007
- 1121
-
From Femtosecond Dynamics to Breast Cancer Diagnosis by Raman SpectroscopyAbramczyk, H. / Placek, I. / Brożek‐Płuska, B. / Kurczewski, K. / Morawiec, Z. / Tazbir, M. et al. | 2007
- 1125
-
Psycho‐Diagnostic Problems of Personalized Teaching SystemsAbu‐Dawwas, Waheeb A. / Al‐Azzeh, Rashed M. / Abu‐Arqoub, Mohammed H. et al. | 2007
- 1128
-
Relational Neural Evolution Approach to Bank Failure PredictionAbudu, Bolanle / Markose, Sheri et al. | 2007
- 1132
-
Aggregative Learning Method and Its Application for Communication Quality EvaluationAkhmetov, Dauren F. / Kotaki, Minoru et al. | 2007
- 1136
-
Using an Interoperable Geoprocessing System for Hydrological SimulationAlarcon, Vladimir J. / O'Hara, Charles G. / Viger, Roland / Shrestha, Bijay / Mali, Preeti et al. | 2007
- 1141
-
Numerical Simulation of the Static Stiffness Problem on a Catenary by using ThreadsAlberto, A. / Arias, E. / Rojo, T. / Cuartero, F. / Benet, J. et al. | 2007
- 1146
-
The Kepler Problem in Rotating Reference Frames: Topological Study of the Phase FlowBalsas, M. C. / Jiménez, E. S. / Vera, J. A. et al. | 2007
- 1150
-
On the Traces of Absolute Enantioselective SynthesisBarabás, Béla / Caglioti, Luciano / Faglioni, Francesco / Florini, Nicola / Lazzeretti, Paolo / Maioli, Marco / Micskei, Károly / Rábai, Gyula / Taddei, Ferdinando / Zucchi, Claudia et al. | 2007
- 1153
-
The Cyclic Coordinate Descent in Hydrothermal Optimization Problems with Non‐Regular LagrangianBayón, L. / Grau, J. M. / Ruiz, M. M. / Suárez, P. M. et al. | 2007
- 1158
-
Numerical Treatment of Schrödinger Coupled Differential EquationsBougouffa, Smail / Al‐Awfi, Saud et al. | 2007
- 1162
-
Applying Multi‐Moves in Parallel Genetic Algorithm for the Flow Shop ProblemBozejko, W. / Wodecki, M. et al. | 2007
- 1166
-
Weld Spot Detection by Color Segmentation and Template ConvolutionCambrini, Luigi / Biber, Jürgen / Hönigmann, Dieter / Löhndorf, Maike et al. | 2007
- 1170
-
Regularity and Discrete Schemes for the Heat Equation on Non‐Smooth DomainsChin, Pius W. M. / Lubuma, Jean M.‐S. / Patidar, Kailash C. et al. | 2007
- 1174
-
The UCCSD(T)/CBS Description of the Symmetric, Negatively Charged Dimer ofCzernek, Jiří et al. | 2007
- 1178
-
Structures and Dynamic Behaviors of Tetra‐hydridodimetallenes, M2H4, ( Ge, Sn): A DFT study and NBO analysisNori‐Shargh, Davood / Roohi, Fahimeh et al. | 2007
- 1183
-
Expectation Matrix Based Quantum Dynamics of a Univariate System at the Zero Fluctuation LimitDemi̇ralp, Metin et al. | 2007
- 1187
-
A Six Degree of Freedom Trajectory Analysis of Spin‐Stabilized ProjectilesGkritzapis, Dimitrios N. / Panagiotopoulos, Elias E. / Margaris, Dionissios P. / Papanikas, Dimitrios G. et al. | 2007
- 1199
-
Coupled Perturbed Hartree‐Fock Calculation of the Static Polarizability for Periodic Systems: Implementation in the CRYSTAL CodeFerrero, M. / Rérat, Michel / Orlando, R. / Dovesi, R. et al. | 2007
- 1204
-
Monte Carlo Simulation of the Adsorption of Methane and Tetrafluorocarbon on Single Walled Carbon NanotubesGhadarghadr, Y. / Hashemianzadeh, S. M. et al. | 2007
- 1208
-
Reconstruction of a Destroyed ‘Dead Leaves’ Tessellation from its Fragments via the Puzzle Fitting FunctionGille, Wilfried et al. | 2007
- 1212
-
Transport Properties of Uranium Dioxide by Molecular Dynamics SimulationGunay, Seçkin D. / Akdere, Unsal / Kavanoz, Birtan / Taşseven, Çetin et al. | 2007
- 1216
-
Intelligent Environmental Sensing with a Phosphate Monitoring System and Online ResourcesHayes, Jer / Cleary, John / Slater, Conor / Lau, King Tong / Diamond, Dermot et al. | 2007
- 1220
-
Visualizations of a n‐ary Fragmentation Process with Neighborhood InteractionHernández, Gonzalo / Fernández, Cesar / León, Roberto / Salinas, Luís et al. | 2007
- 1224
-
Interpretation of Electronically Excited States by Means of Configuration AnalysisHosokawa, Kiyotada / Sato, Shin‐ichiro et al. | 2007
- 1228
-
Taiwan's Information Security Policy Enhancement: an Analysis of Patent Indicators and Patent DocumentsHsu, Nai‐Wen / Liang, Jr‐Shiuan / Chen, Yi‐Chang et al. | 2007
- 1232
-
Artificial Neural Networks Equivalent to Fuzzy Algebra T‐Norm Conjunction OperatorsIliadis, L. S. / Spartalis, S. I. et al. | 2007
- 1236
-
Molecular Dynamics Simulation of Crystallization under Quiescent and Shearing ConditionsJabbarzadeh, A. / Tanner, R. I. et al. | 2007
- 1240
-
Modelling of RF Discharge in Argon PlasmaJelínek, P. / Virostko, P. / Hubicka, Z. / Bartoš, P. et al. | 2007
- 1244
-
New MP2 Database of Nucleic Acid Base Trimers: How Well Reproduce DFT Methods Structure and Binding Energies?Kabeláč, Martin / Valdes, Haydee / Sherer, Edward C. / Cramer, Christopher J. / Hobza, Pavel et al. | 2007
- 1248
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A Step Towards Planification of Focused Ultrasound ThermoablationKabongo, Luis / Desbarats, Pascal / Dumont, Erik et al. | 2007
- 1253
-
An Exponentially Fitted 6(4) Pair of Explicit Runge‐Kutta‐Nyström MethodsKalogiratou, Z. / Monovasilis, Th. / Simos, T. E. et al. | 2007
- 1257
-
Simulation of Turbulent Flow through Porous Media Employing a v2f ModelKazerooni, Reza Bahoosh / Hannani, Siamak Kazemzadeh et al. | 2007
- 1261
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Ab initio FMO‐MD Method Reimplemented and Applied to Pure WaterKomeiji, Yuto / Ishikawa, Takeshi / Mochizuki, Yuji / Yamataka, Hiroshi / Nakano, Tatsuya et al. | 2007
- 1265
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Online Visual Quality Inspection for Weld SeamsLöhndorf, Maike / Ramoser, Herbert / Cambrini, Luigi et al. | 2007
- 1269
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Numerical Solution of the Velocity‐Vorticity Navier‐Stokes Equations in Three Dimensions for an Incompressible Newtonian FluidLoukopoulos, V. C. / Karahalios, G. T. et al. | 2007
- 1273
-
Predicting Human Transcription Starts by use of Diversity Measure with Quadratic DiscriminantLu, Jun / Luo, Liaofu et al. | 2007
- 1278
-
Sequence Pattern Recognition in Genome AnalysisLuo, Liaofu / Lu, Jun et al. | 2007
- 1282
-
Potentials of Mean Force of Two Hydrophobic Amino‐Acid Side Chain Models Dependent on OrientationMakowski, Mariusz / Chmurzyński, Lech et al. | 2007
- 1285
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Assessing the Environmental Impact of Slate Quarrying Using Bayesian Networks and GISMatías, J. M. / Rivas, T. / Ordóñez, C. / Taboada, J. et al. | 2007
- 1289
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Forecasting Electricity Prices in an Optimization Hydrothermal ProblemMatías, J. M. / Bayón, L. / Suárez, P. / Argüelles, A. / Taboada, J. et al. | 2007
- 1293
-
Influence of Temperature on the Offset Voltage of Piezoresistive Pressure SensorsLain, Mohamed Ras / Chaabi, Abdelhafid et al. | 2007
- 1298
-
A Conservative Galerkin‐Characteristics Algorithm Combined with a Relaxation Scheme for Two Regions Nonlinear Solute Transport Problem in Porous MediaMahmood, Mohammed Shuker et al. | 2007
- 1302
-
Analysis of Some Orbital Contributions to the Current Density in CirculenesMonaco, Guglielmo / Zanasi, Riccardo et al. | 2007
- 1306
-
A Family of Trigonometrically‐fitted Partitioned Runge‐Kutta Symplectic MethodsMonovasilis, Th. / Kalogiratou, Z. / Simos, T. E. et al. | 2007
- 1311
-
Theoretical Study of 1,8‐Diaminonaphthalene PolymerizationNateghi, Mohammad R. / Kalantari, F. et al. | 2007
- 1315
-
An Accurate Finite‐Difference Scheme on Second Order Partial Differential Equations in 3DNiakas, N. / Loukopoulos, V. C. / Douskos, C. et al. | 2007
- 1319
-
Acoustic Analysis of a Sandwich Non Metallic Panel for Roofs by FEM and Experimental ValidationNieto, P. J. García / del Coz Díaz, J. J. / Vilán, J. A. Vilán / Rabanal, F. P. Alvarez et al. | 2007
- 1323
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Application of the CVP Method on 3D Internal FlowsPapadopoulos, Polycarpos K. / Hatzikonstantinou, Pavlos M. et al. | 2007
- 1327
-
Evaluation of a Natural Ventilation Configuration at a Public BuildingPapakonstantinou, K. / Belias, C. / Vlachakis, N. / Statharas, I. et al. | 2007
- 1331
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Atomic Calculations Applied to Semiconductor Hetero StructuresPedesseau, L. / Even, J. / Doré, F. / Cornet, C. et al. | 2007
- 1335
-
Usefulness of Neuro‐Fuzzy Models' Application for Tobacco ControlPetrovic‐Lazarevic, Sonja / Zhang, Jian Ying et al. | 2007
- 1339
-
Theoretical Investigation of the Unexpected Red Shift in the Halothane…Acetone ComplexPluháčková, Kristýna / Hobza, Pavel et al. | 2007
- 1343
-
Contraction Maps on Complexity Spaces and itExpoDC AlgorithmsRomaguera, S. / Schellekens, M. P. / Tirado, P. / Valero, O. et al. | 2007
- 1347
-
A Java Library for the Calculation of Molecular DescriptorsRuiz, Irene Luque / Gómez‐Nieto, Miguel Ángel et al. | 2007
- 1351
-
Fuzzy Constraint Based Model for Efficient Management of Dynamic Purchasing EnvironmentsSakas, D. P. / Vlachos, D. S. / Simos, T. E. et al. | 2007
- 1355
-
Adaptive Neural Networks for Automatic NegotiationSakas, D. P. / Vlachos, D. S. / Simos, T. E. et al. | 2007
- 1359
-
Adaptive Techniques for Online AuctionsSakas, D. P. / Vlachos, D. S. / Simos, T. E. et al. | 2007
- 1363
-
Calculation of Elastic Constants for GlassesSavchenko, Nicolai D. / Shchurova, Tatiana N. / Kondrat, Alexander B. / Mitsa, Vladimir M. et al. | 2007
- 1367
-
Numerical Studies of Flow past Two Side‐by‐Side Circular CylindersShao, J. / Zhang, C. et al. | 2007
- 1371
-
Quantal Cumulant Dynamics for Dissipative SystemsShigeta, Yasuteru et al. | 2007
- 1375
-
Towards Simulations of Outer Membrane Proteins in Lipopolysaccharide MembranesSoares, T. A. / Straatsma, T. P. et al. | 2007
- 1379
-
Data Intensive Analysis of Biomolecular SimulationsStraatsma, T. P. et al. | 2007
- 1383
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The Convolution Method in Neutrino Physics SearchesTsakstara, V. / Kosmas, T. S. / Sinatkas, J. / Chasioti, V. C. / Divari, P. C. et al. | 2007
- 1388
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Molecular Dynamic Simulation of Detonation PhenomenaUtkin, A. V. / Golovnev, I. F. / Fomin, V. M. et al. | 2007
- 1392
-
Image Recognition Techniques for Gamma SpectroscopyVlachos, D. S. / Tsabaris, C. G. et al. | 2007
- 1396
-
Optimized Derivative Kernels for Gamma Ray SpectroscopyVlachos, D. S. / Kosmas, O. T. / Simos, T. E. et al. | 2007
- 1400
-
Indexing Degenerate StringsVoráček, Michal / Vagner, Ladislav / Flouri, Tomáš et al. | 2007
- 1404
-
Image Normalization and Discrete Wavelet Transform Based Robust Digital Image WatermarkingVural, Cabir / Kazan, Serap et al. | 2007
- 1408
-
Fuzzy Neural Classifiers for Multi‐Wavelength Interdigital SensorsXenides, D. / Vlachos, D. S. / Simos, T. E. et al. | 2007
- 1412
-
A New Heuristic Algorithm for Solving the Job Shop Scheduling ProblemYin, Aihua / Zhang, Shousheng et al. | 2007
- 1417
-
Numerical Modeling of Energy Consumption in a Typical Residential BuildingZhang, L. / Zhang, C. / Martinuzzi, R. et al. | 2007
- 1421
-
Downfolding and N‐ization of Basis Sets of Slater Type OrbitalsZurek, Eva / Autschbach, Jochen / Andersen, Ole Krogh et al. | 2007
- 1425
-
Density Functional Studies of the NMR Chemical Shifts in Single–Walled Carbon NanotubesZurek, Eva / Autschbach, Jochen et al. | 2007
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Front Matter for Volume 963| 2007
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Back Matter for Volume 963| 2007