Relativistic DFT Studies of Dehydrogenation of Methane by Pt Cationic Clusters: Cooperative Effect of Bimetallic Clusters (English)
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- New search for: Xia, F.
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The journal of physical chemistry <Washington, DC> / B
;
110
, 33
; 10078-10083
;
2006
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ISSN:
- Article (Journal) / Print
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Title:Relativistic DFT Studies of Dehydrogenation of Methane by Pt Cationic Clusters: Cooperative Effect of Bimetallic Clusters
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Published in:The journal of physical chemistry <Washington, DC> / B ; 110, 33 ; 10078-10083
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- New search for: Soc.
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Place of publication:Washington, DC
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Publication date:2006
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 35.10
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Table of contents – Volume 110, Issue 33
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.
- 9983
-
Explicit Dynamical Electron-Proton Correlation in the Nuclear-Electronic Orbital FrameworkSwalina, C. et al. | 2006
- 9988
-
Early Excited State Dynamics of 6-Styryl-Substituted Pyrylium Salts Exhibiting Dual FluorescencePigliucci, A. et al. | 2006
- 9995
-
Relative Energy and Structural Differences of Axial and Equatorial 1-Fluoro-1-silacyclohexaneFavero, L.B. et al. | 2006
- 10000
-
Vibronic Structure in the S1-S0 Transition of Jet-Cooled DibenzofuranBaba, M. et al. | 2006
- 10006
-
Asymmetric Top Rotors in Electric Fields. II. Influence of Internal Torsions in Molecular Beam Deflection ExperimentsAntoine, R. et al. | 2006
- 10012
-
Emission Spectra and Electronic Energy Levels of the Rotational Isomers of Pyridinecarboxaldehyde VaporsItoh, T. et al. | 2006
- 10018
-
Theoretical and Experimental Analysis of Ammonia Ionic Clusters Produced by 252Cf Fragment Impact on an NH3 Ice TargetFernandez-Lima, F.A. et al. | 2006
- 10025
-
Amine-Hydrogen Halide Complexes: Experimental Electric Dipole Moments and a Theoretical Decomposition of Dipole Moments and Binding EnergiesBrauer, C.S. et al. | 2006
- 10035
-
Infrared Spectra of M(OH)1,2,3 (M = Mn, Fe, Co, Ni) Molecules in Solid Argon and the Character of First Row Transition Metal Hydroxide BondingWang, X. et al. | 2006
- 10046
-
Infrared Spectra and Intensities of the H2O and N2 Complexes in the Range of the &ngr;1- and &ngr;3-Bands of WaterKuma, S. et al. | 2006
- 10053
-
SAC and SAC-CI Calculations of Excitation and Circular Dichroism Spectra of Straight-Chain and Cyclic DichalcogensSeino, J. et al. | 2006
- 10063
-
Infrared Spectra of the CH3-MX, CH2&dbd;MHX, and CH&tbd1;MH2X- Complexes Formed by Reaction of Methyl Halides with Laser-ablated Group 5 Metal AtomsCho, H.-G. et al. | 2006
- 10078
-
Relativistic DFT Studies of Dehydrogenation of Methane by Pt Cationic Clusters: Cooperative Effect of Bimetallic ClustersXia, F. et al. | 2006
- 10084
-
Solid-State 25Mg NMR Spectroscopic and Computational Studies of Organic Compounds. Square-Pyramidal Magnesium(II) Ions in Aqua(magnesium) Phthalocyanine and Chlorophyll aWong, A. et al. | 2006
- 10091
-
DFT and Experimental Examination of the Oxidation-Reduction of a Thiol-Substituted Carotenoid with Gold versus Glassy Carbon ElectrodesGao, Y. et al. | 2006
- 10098
-
Oligothiophene Catenanes and Knots: A Theoretical StudyFomine, S. et al. | 2006
- 10106
-
Topology of Charge Density of Flucytosine and Related Molecules and Characteristics of their Bond Charge DistributionsMurgich, J. et al. | 2006
- 10116
-
The Heats of Formation of Diazene, Hydrazine, N2H3+, N2H5+, N2H, and N2H3 and the Methyl Derivatives CH3NNH, CH3NNCH3, and CH3HNNHCH3Matus, M.H. et al. | 2006
- 10122
-
Polar Effects and Structural Variation in 4-Substituted 1-Phenylbicyclo[2.2.2]octane Derivatives: A Quantum Chemical StudyCampanelli, A.R. et al. | 2006
- 10130
-
A Computational Study on the Kinetics and Mechanism for the Unimolecular Decomposition of o-NitrotolueneChen, S.C. et al. | 2006
- 10135
-
Clar's Sextet Rule Is a Consequence of the &sgr;-Electron FrameworkMaksic, Z.B. et al. | 2006
- 10148
-
A Computational Study on &pgr; and &sgr; Modes of Metal Ion Binding to Heteroaromatics (CH)5-mXm and (CH)6-mXm (X = N and P): Contrasting Preferences Between Nitrogen- and Phosphorous-Substituted Rings†Vijay, D. et al. | 2006
- 10155
-
Theoretical Determination of the Rate Constant for OH Hydrogen Abstraction from TolueneUc, V.H. et al. | 2006
- 10163
-
Magnitude and Directionality of the Interaction Energy of the Aliphatic CH-&pgr; Interaction: Significant Difference from Hydrogen BondTsuzuki, S. et al. | 2006
- 16159
-
Fast Electron Transport in Metal Organic Vapor Deposition Grown Dye-sensitized ZnO Nanorod Solar CellsGaloppini, Elena / Rochford, Jonathan / Chen, Hanhong / Saraf, Gaurav / Lu, Yicheng / Hagfeldt, Anders / Boschloo, Gerrit et al. | 2006
- 16162
-
Identification of CO Adsorption Sites in Supported Pt Catalysts Using High-Energy-Resolution Fluorescence Detection X-ray SpectroscopySafonova, Olga V. / Tromp, Moniek / van Bokhoven, Jeroen A. / de Groot, Frank M. F. / Evans, John / Glatzel, Pieter et al. | 2006
- 16165
-
Influence of Ordering in Porous TiO2 Layers on Electron DiffusionTirosh, Shay / Dittrich, Thomas / Ofir, Ashi / Grinis, Larisa / Zaban, Arie et al. | 2006
- 16169
-
Harvesting Infrared Photons with Tricarbocyanine Dye ClustersTakechi, Kensuke / Sudeep, P. K. / Kamat, Prashant V. et al. | 2006
- 16174
-
Additivity in the Optical Kerr Effect Spectra of Binary Ionic Liquid Mixtures: Implications for Nanostructural OrganizationXiao, Dong / Rajian, Justin Rajesh / Li, Shengfu / Bartsch, Richard A. / Quitevis, Edward L. et al. | 2006
- 16179
-
Anodic Growth of Highly Ordered TiO~2 Nanotube Arrays to 134 mum in LengthPaulose, M. / Shankar, K. / Yoriya, S. / Prakasam, H. E. / Varghese, O. K. / Mor, G. K. / Latempa, T. A. / Fitzgerald, A. / Grimes, C. A. et al. | 2006
- 16179
-
Anodic Growth of Highly Ordered TiO2 Nanotube Arrays to 134 μm in LengthPaulose, Maggie / Shankar, Karthik / Yoriya, Sorachon / Prakasam, Haripriya E. / Varghese, Oomman K. / Mor, Gopal K. / Latempa, Thomas A. / Fitzgerald, Adriana / Grimes, Craig A. et al. | 2006
- 16185
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Highly Dispersed Pt Catalysts on Single-Walled Carbon Nanotubes and Their Role in Methanol OxidationKongkanand, Anusorn / Vinodgopal, K. / Kuwabata, Susumu / Kamat, Prashant V. et al. | 2006
- 16189
-
Evidence of Variable H-Bond Network for Nitroxide Radicals in Protic SolventsPavone, Michele / Sillanpää, Atte / Cimino, Paola / Crescenzi, Orlando / Barone, Vincenzo et al. | 2006
- 16193
-
The Onion-Ring Structure for Pd−Pt Bimetallic ClustersCheng, Daojian / Wang, Wenchuan / Huang, Shiping et al. | 2006
- 16197
-
Evidence of Two-Dimensional Superconductivity in the Single Crystalline Nanohybrid of Organic-Bismuth CuprateChung, Il-Won / Kwon, Soon-Jae / Kim, Seung-Joo / Jang, Eue Soon / Hwang, Seong-Ju / Choy, Jin-Ho et al. | 2006
- 16201
-
Direct Measurement of the Internal Electron Quasi-Fermi Level in Dye Sensitized Solar Cells Using a Titanium Secondary ElectrodeLobato, K. / Peter, L. M. / Würfel, U. et al. | 2006
- 16205
-
Why Ionic Liquids Can Possess Extra Solvent PowerAerov, Artem A. / Khokhlov, Alexei R. / Potemkin, Igor I. et al. | 2006
- 16208
-
Self-assembly Synthesis of Single-Crystalline Tin Oxide Nanostructures by a Poly(acrylic acid)-Assisted Solvothermal ProcessCheng, Guoe / Wang, Jinmin / Liu, Xiangwen / Huang, Kaixun et al. | 2006
- 16212
-
FTIR Study on the Formation of TiO2 Nanostructures in Supercritical CO2Sui, Ruohong / Rizkalla, Amin S. / Charpentier, Paul A. et al. | 2006
- 16219
-
Phenanthrene Adsorption from Solution on Single Wall Carbon NanotubesGotovac, Suzana / Hattori, Yoshiyuki / Noguchi, Daisuke / Miyamoto, Jun-ichi / Kanamaru, Mamiko / Utsumi, Shigenori / Kanoh, Hirofumi / Kaneko, Katsumi et al. | 2006
- 16225
-
Hydrogen Sorption on Palladium-Doped Sepiolite-Derived Carbon NanofibersBack, Chang-Keun / Sandí, Giselle / Prakash, Jai / Hranisavljevic, Jasmina et al. | 2006
- 16232
-
19F Single-Quantum and 19F−33S Heteronuclear Multiple-Quantum Coherence NMR of SF6 in Thermotropic Nematogens and in the Gas PhaseTervonen, Henri / Saunavaara, Jani / Ingman, L. Petri / Jokisaari, Jukka et al. | 2006
- 16239
-
Molecular Conformation and Melting Behavior of Alkyl/Oligo(oxyethylene)/Alkyl Triblock Position Isomers: Effect of the Position of an Oligo(oxyethylene) BlockFukuhara, Koichi / Kumamoto, Hirotaka / Matsuura, Hiroatsu et al. | 2006
- 16248
-
Silver Colloid Nanoparticles: Synthesis, Characterization, and Their Antibacterial ActivityPanáček, Aleš / Kvítek, Libor / Prucek, Robert / Kolář, Milan / Večeřová, Renata / Pizúrová, Naděžda / Sharma, Virender K. / Nevěčná, Tat‘jana / Zbořil, Radek et al. | 2006
- 16254
-
Detailed in Situ XRD and Calorimetric Study of the Formation of Silicate/Mixed Surfactant Mesophases under Alkaline Conditions. Influence of Surfactant Chain Length and Synthesis TemperatureBeurroies, Isabelle / Ågren, Patrik / Büchel, Gunter / Rosenholm, Jarl B. / Amenitsch, Heinz / Denoyel, Renaud / Linden, Mika et al. | 2006
- 16261
-
Characterization of ZnE (E = S, Se, or Te) Materials Synthesized Using Silylated Chalcogen Reagents in Mesoporous MCM-41Turner, Elizabeth A. / Rösner, Harald / Fenske, Dieter / Huang, Yining / Corrigan, John F. et al. | 2006
- 16270
-
Electrical Properties and Defect Chemistry of TiO2 Single Crystal. I. Electrical Conductivity †Nowotny, M. K. / Bak, T. / Nowotny, J. et al. | 2006
- 16283
-
Electrical Properties and Defect Chemistry of TiO2 Single Crystal. II. Thermoelectric Power †Nowotny, M. K. / Bak, T. / Nowotny, J. et al. | 2006
- 16292
-
Electrical Properties and Defect Chemistry of TiO2 Single Crystal. III. Equilibration Kinetics and Chemical Diffusion †Nowotny, M. K. / Bak, T. / Nowotny, J. et al. | 2006
- 16302
-
Electrical Properties and Defect Chemistry of TiO2 Single Crystal. IV. Prolonged Oxidation Kinetics and Chemical Diffusion †Nowotny, M. K. / Bak, T. / Nowotny, J. et al. | 2006
- 16309
-
Stabilization of Catanionic Vesicles via PolymerizationZhu, Zhiyuan / Xu, Hangxun / Liu, Hewen / González, Yamaira I. / Kaler, Eric W. / Liu, Shiyong et al. | 2006
- 16318
-
Anomalous Ionic Conductivity Increase in Li2S + GeS2 + GeO2 GlassesKim, Youngsik / Saienga, Jason / Martin, Steve W. et al. | 2006
- 16326
-
Near-Infrared Spectroscopy Investigation of the Water Confined in Tricalcium Silicate PastesRidi, Francesca / Fratini, Emiliano / Milani, Silvia / Baglioni, Piero et al. | 2006
- 16332
-
Temperature and Size Effects on Diffusion in Carbon NanotubesJakobtorweihen, S. / Keil, F. J. / Smit, B. et al. | 2006
- 16337
-
On the Electronic Structure of Neutral and Ionic Azobenzenes and Their Possible Role as Surface Mounted Molecular SwitchesFüchsel, Gernot / Klamroth, Tillmann / Dokić, Jadranka / Saalfrank, Peter et al. | 2006
- 16346
-
Effect of Apical Defects and Doped Atoms on Field Emission of Boron Nitride NanoconesAn, Wei / Wu, Xiaojun / Zeng, X. C. et al. | 2006
- 16353
-
Free Radical Sensor Based on CdSe Quantum Dots with Added 4-Amino-2,2,6,6-Tetramethylpiperidine Oxide FunctionalityMaurel, Vincent / Laferrière, Marie / Billone, Paul / Godin, Robert / Scaiano, J. C. et al. | 2006
- 16359
-
Enhanced Sensitivity for Biosensors: Multiple Functions of DNA-Wrapped Single-Walled Carbon Nanotubes in Self-Doped Polyaniline NanocompositesMa, Yufeng / Ali, Shah R. / Dodoo, Afua S. / He, Huixin et al. | 2006
- 16366
-
Hidden Markov Model Analysis of Multichromophore PhotobleachingMessina, Troy C. / Kim, Hiyun / Giurleo, Jason T. / Talaga, David S. et al. | 2006
- 16377
-
Growth of Gold Nanorods and Bipyramids Using CTEAB SurfactantKou, Xiaoshan / Zhang, Shuzhuo / Tsung, Chia-Kuang / Yeung, Man Hau / Shi, Qihui / Stucky, Galen D. / Sun, Lingdong / Wang, Jianfang / Yan, Chunhua et al. | 2006
- 16384
-
Composite Thermal Conductivity in a Large Heterogeneous Porous Methane Hydrate SampleGupta, Arvind / Kneafsey, Timothy J. / Moridis, George J. / Seol, Yongkoo / Kowalsky, Michael B. / Sloan, E. D. et al. | 2006
- 16393
-
Defects Can Increase the Melting Temperature of DNA−Nanoparticle AssembliesHarris, Nolan C. / Kiang, Ching-Hwa et al. | 2006
- 16397
-
Thermally Induced Solid-State Phase Transition of Bis(triisopropylsilylethynyl) Pentacene CrystalsChen, Jihua / Anthony, John / Martin, David C. et al. | 2006
- 16404
-
Synthesis of Polygonized Carbon Nanotubes Utilizing Inhomogeneous Catalyst Activity of Nonspherical Fe3O4 NanoparticlesQian, Wen / Chen, Jiafu / Wu, Liusuo / Cao, Fangyu / Chen, Qianwang et al. | 2006
- 16408
-
Atomistic Origin of Germanate Anomaly in GeO2 and Na-Germanate Glasses: Insights from Two-Dimensional 17O NMR and Quantum Chemical CalculationsLee, Sung Keun / Lee, Bum Han et al. | 2006
- 16413
-
Probing CuI-Exchanged Zeolite with CO: DFT Modeling and ExperimentJardillier, Nicolas / Villagomez, Enrique Ayala / Delahay, Gérard / Coq, Bernard / Berthomieu, Dorothée et al. | 2006
- 16422
-
Synergism of C5N Six-Membered Ring and Vapor−Liquid−Solid Growth of CN x Nanotubes with Pyridine PrecursorChen, Hong / Yang, Yong / Hu, Zheng / Huo, Kaifu / Ma, Yanwen / Chen, Yi / Wang, Xiaoshu / Lu, Yinong et al. | 2006
- 16428
-
Cyclodextrin Cavity Size Effect on the Complexation and Rotational Dynamics of the Laser Dye 2,5-Diphenyl-1,3,4-oxadiazole: From Singly Occupied Complexes to Their Nanotubular Self-AssembliesPistolis, George / Balomenou, Ioanna et al. | 2006
- 16439
-
Adsorption of Small Au n (n = 1−5) and Au−Pd Clusters Inside the TS-1 and S-1 PoresJoshi, Ajay M. / Delgass, W. Nicholas / Thomson, Kendall T. et al. | 2006
- 16452
-
Effect of Molecular Weight on the Morphological Modifications Induced by UV Laser Ablation of Doped PolymersRebollar, Esther / Bounos, Giannis / Oujja, Mohamed / Georgiou, Savas / Castillejo, Marta et al. | 2006
- 16459
-
Structural and Orientational Properties of the Ferro, Antiferroelectric, and Re-entrant Smectic C* Phases of ZLL7/* by Deuterium NMR and Other Experimental TechniquesCatalano, Donata / Domenici, Valentina / Marini, Alberto / Veracini, Carlo Alberto / Bubnov, Alexej / Glogarová, Milada et al. | 2006
- 16471
-
Mechanism of Nanoparticle Formation in Self-Assembled Colloidal Templates: Population Balance Model and Monte Carlo SimulationEthayaraja, M. / Dutta, Kanchan / Bandyopadhyaya, Rajdip et al. | 2006
- 16482
-
Influence of N-Doping on the Structure and Electronic Properties of Titania Nanoparticle PhotocatalystsStewart, Silvana J. / Fernández-García, Marcos / Belver, Carolina / Mun, B. Simon / Requejo, Félix G. et al. | 2006
- 16487
-
Deuterium NMR and Differential Scanning Calorimetric Studies of the Calcium Salts of Rhodium and Iridium Pentadeuterides, Ca2RhD5 and Ca2IrD5Gilson, Denis F. R. / Morin, Frederick G. / Moyer, Ralph O. et al. | 2006
- 16491
-
Quenching and Blinking of Fluorescence of a Single Dye Molecule Bound to Gold NanoparticlesCannone, Fabio / Chirico, Giuseppe / Bizzarri, Anna Rita / Cannistraro, Salvatore et al. | 2006
- 16499
-
Depth Profiling of Charging Effect of Si Nanocrystals Embedded in SiO2: A Study of Charge Diffusion among Si NanocrystalsLiu, Y. / Chen, T. P. / Ng, C. Y. / Ding, L. / Zhang, S. / Fu, Y. Q. / Fung, S. et al. | 2006
- 16503
-
Fabrication of Novel Supramolecular Hydrogels with High Mechanical Strength and Adjustable ThermosensitivityZhao, San-Ping / Zhang, Li-Ming / Ma, Dong / Yang, Chuan / Yan, Li et al. | 2006
- 16508
-
Colloidal CdSe Nanocrystals Synthesized in Noncoordinating Solvents with the Addition of a Secondary Ligand: Exceptional Growth KineticsDai, Quanqin / Li, Dongmei / Chen, Haiyong / Kan, Shihai / Li, Hongdong / Gao, Shiyong / Hou, Yuanyuan / Liu, Bingbing / Zou, Guangtian et al. | 2006
- 16514
-
Kinetics of Solute Adsorption at Solid/Solution Interfaces: A Theoretical Development of the Empirical Pseudo-First and Pseudo-Second Order Kinetic Rate Equations, Based on Applying the Statistical Rate Theory of Interfacial TransportRudzinski, Wladyslaw / Plazinski, Wojciech et al. | 2006
- 16526
-
Growth Mechanism of a Gas Clathrate Hydrate from a Dilute Aqueous Gas Solution: A Molecular Dynamics Simulation of a Three-Phase SystemNada, Hiroki et al. | 2006
- 16535
-
Electrical Bias Dependent Photochemical Functionalization of Diamond SurfacesNichols, Beth M. / Metz, Kevin M. / Tse, Kiu-Yuen / Butler, James E. / Russell,, John N. / Hamers, Robert J. et al. | 2006
- 16544
-
Temperature Dependence of Oxygen Reduction Activity at Nafion-Coated Bulk Pt and Pt/Carbon Black CatalystsYano, Hiroshi / Higuchi, Eiji / Uchida, Hiroyuki / Watanabe, Masahiro et al. | 2006
- 16550
-
Estimation of the Orientation of Heme in Cytochrome c Immobilized on a Carboxylate-Terminated Alkanethiol Monolayer on a Au Electrode by the Use of Electroreflectance Spectroscopy with Polarized Light IncidenceSagara, Takamasa / Kubo, Yuu / Hiraishi, Keizo et al. | 2006
- 16559
-
Mechanistic Study of Electrocatalytic Oxidation of Formic Acid at Platinum in Acidic Solution by Time-Resolved Surface-Enhanced Infrared Absorption SpectroscopySamjeské, Gabor / Miki, Atsushi / Ye, Shen / Osawa, Masatoshi et al. | 2006
- 16567
-
Sum Frequency Generation Study of Langmuir Blodgett Film ArchitectureJohansson, T. P. / Leach, G. W. et al. | 2006
- 16575
-
Differing Adsorption Behavior of Environmentally Important Cyanophenol Isomers at the Air−Water InterfaceKido Soule, Melissa C. / Hore, Dennis K. / Jaramillo-Fellin, Donna M. / Richmond, Geraldine L. et al. | 2006
- 16584
-
Gauging the Effect of Impurities on Lipid Bilayer Phase Transition TemperatureKoan, Monique M. / Blanchard, G. J. et al. | 2006
- 16591
-
Thermodynamic Equilibrium Compositions, Structures, and Reaction Energies of Pt x O y (x = 1−3) Clusters Predicted from First PrinciplesXu, Ye / Shelton, William A. / Schneider, William F. et al. | 2006
- 16600
-
The Surface Dependence of CO Adsorption on CeriaNolan, Michael / Watson, Graeme W. et al. | 2006
- 16607
-
Photoinduced Electron Transfer in a Protein−Surfactant Complex: Probing the Interaction of SDS with BSAChakraborty, Anjan / Seth, Debabrata / Setua, Palash / Sarkar, Nilmoni et al. | 2006
- 16618
-
Structural Rearrangements During the Initial Growth Stages of Organic Thin Films of F16CuPc on SiO2de Oteyza, Dimas G. / Barrena, Esther / Sellner, Stefan / Ossó, J. Oriol / Dosch, Helmut et al. | 2006
- 16624
-
Anisotropic Adsorption of Molecular Assemblies on Crystalline SurfacesChun, Jaehun / Li, Je-Luen / Car, Roberto / Aksay, Ilhan A. / Saville, Dudley A. et al. | 2006
- 16633
-
In Situ Investigation of Acetonitrile Adsorption on Al2O3-Coated CaF2 Using Sum-Frequency SpectroscopyWaldrup, S. Beau / Williams, Christopher T. et al. | 2006
- 16640
-
Modeling Competitive Guest Binding to β-Cyclodextrin Molecular PrintboardsThompson, D. / Larsson, J. A. et al. | 2006
- 16640
-
Modeling Competitive Guest Binding to beta-Cyclodextrin Molecular PrintboardsThompson, D. / Larsson, J. A. et al. | 2006
- 16646
-
Investigation of Free Base, Mg, Sn, and Zn Substituted Porphyrin LB Films as Gas Sensors for Organic AnalytesDunbar, Alan D. F. / Richardson, Tim H. / McNaughton, Alex J. / Hutchinson, Jordan / Hunter, Chris A. et al. | 2006
- 16652
-
Semiempirical (ZINDO-PCM) Approach to Predict the Radiative and Nonradiative Decay Rates of a Molecule Close to Metal ParticlesCaricato, Marco / Andreussi, Oliviero / Corni, Stefano et al. | 2006
- 16660
-
Ab Initio Studies on Nanoscale Friction between Fluorinated Diamond Surfaces: Effect of Model Size and Level of TheoryNeitola, Raisa / Pakkanen, Tapani A. et al. | 2006
- 16666
-
Quantum Effects on Adsorption and Diffusion of Hydrogen and Deuterium in Microporous MaterialsKumar, A. V. Anil / Jobic, Hervé / Bhatia, Suresh K. et al. | 2006
- 16672
-
Polyamidoamine Dendrimers-Assisted Electrodeposition of Gold−Platinum Bimetallic NanoflowersQian, Lei / Yang, Xiurong et al. | 2006
- 16679
-
Thermodynamics of Activated Phase Transitions of 8CB: DSC and MC CalorimetrySharma, Dipti / MacDonald, John C. / Iannacchione, Germano S. et al. | 2006
- 16685
-
Molecular Simulations of Physical Aging in Polymer Membrane MaterialsWang, Xiao-Yan / Willmore, Frank T. / Raharjo, Roy D. / Wang, Xiaochu / Freeman, Benny D. / Hill, Anita J. / Sanchez, Isaac C. et al. | 2006
- 16694
-
Statistical Associating Fluid Theory Coupled with Restrictive Primitive Model Extended to Bivalent Ions. SAFT2: 1. Single Salt + Water SolutionsTan, Sugata P. / Ji, Xiaoyan / Adidharma, Hertanto / Radosz, Maciej et al. | 2006
- 16700
-
Statistical Associating Fluid Theory Coupled with Restrictive Primitive Model Extended to Bivalent Ions. SAFT2: 2. Brine/Seawater Properties PredictedJi, Xiaoyan / Tan, Sugata P. / Adidharma, Hertanto / Radosz, Maciej et al. | 2006
- 16707
-
Quantifying Polypeptide Conformational Space: Sensitivity to Conformation and Ensemble DefinitionSullivan, David C. / Lim, Carmay et al. | 2006
- 16718
-
Conformational Equilibrium in Alanine-Rich Peptides Probed by Reversible Stretching SimulationsHénin, Jérôme / Schulten, Klaus / Chipot, Christophe et al. | 2006
- 16724
-
Characteristic Structure and Environment in FAD Cofactor of (6−4) Photolyase along Function Revealed by Resonance Raman SpectroscopyLi, Jiang / Uchida, Takeshi / Ohta, Takehiro / Todo, Takeshi / Kitagawa, Teizo et al. | 2006
- 16733
-
Monte Carlo vs Molecular Dynamics for All-Atom Polypeptide Folding SimulationsUlmschneider, Jakob P. / Ulmschneider, Martin B. / Di Nola, Alfredo et al. | 2006
- 16743
-
Modulation of Amphotericin B Membrane Interaction by Cholesterol and ErgosterolA Molecular Dynamics StudyCzub, Jacek / Baginski, Maciej et al. | 2006
- 16754
-
Molecular Dynamics Simulations of the Enzyme Cu, Zn Superoxide DismutaseBranco, Ricardo J. F. / Fernandes, Pedro A. / Ramos, Maria J. et al. | 2006
- 16763
-
X-ray Microscopy Studies of Protein Adsorption on a Phase-Segregated Polystyrene/Polymethyl Methacrylate Surface. 1. Concentration and Exposure-Time Dependence for Albumin AdsorptionLi / Hitchcock, Adam P. / Robar, Nicholas / Cornelius, Rena / Brash, John L. / Scholl, Andreas / Doran, Andrew et al. | 2006
- 16774
-
pH-Dependent Electronic and Spectroscopic Properties of Pyridoxine (Vitamin B6)Ristilä, Mikael / Matxain, Jon M. / Strid, Åke / Eriksson, Leif A. et al. | 2006
- 16781
-
Photoluminescence of a Covalent Assembled Porphyrin-Based Monolayer: Optical Behavior in the Presence of O2Gulino, Antonino / Giuffrida, Salvatore / Mineo, Placido / Purrazzo, Michele / Scamporrino, Emilio / Ventimiglia, Giorgio / van der Boom, Milko E. / Fragalà, Ignazio et al. | 2006
- 16787
-
Surface-Enhanced Raman Scattering Studies of Human Transcriptional Coactivator p300Pavan Kumar, G. V. / Ashok Reddy, B. A. / Arif, Mohammed / Kundu, Tapas K. / Narayana, Chandrabhas et al. | 2006
- 16793
-
Experimental and DFT Study of the Partial Oxidation of Benzene by N2O over H-ZSM-5: Acid Catalyzed MechanismEsteves, Pierre M. / Louis, Benoît et al. | 2006
- 16801
-
Polymorphism in Micro-, Submicro-, and Nanocrystalline NaNbO3Shiratori, Yosuke / Magrez, Arnaud / Dornseiffer, Jürgen / Haegel, Franz-Hubert / Pithan, Christian / Waser, Rainer et al. | 2006