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Advances in Enhanced Sampling Molecular Dynamics Simulations for Biomolecules
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High Resolution Crossed Molecular Beams Study of the H+HD→H2+D Reaction
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Probing the Electronic Structure of the CoB16- Drum Complex: Unusual Oxidation State of Co-1
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van der Waals Interactions in Bimolecular Reactions
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Femtosecond Time-Resolved Spectroscopic Photoemission Electron Microscopy for Probing Ultrafast Carrier Dynamics in Heterojunctions
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Cavity-Enhanced Saturation Spectroscopy of Molecules with sub-kHz Accuracy
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Site-Dependent TERS Study of a Porphyrin Molecule on Ag(100) at 7 K
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Imaging the Dissociation Dynamics of Si2+ via Two-Photon Excitation at 193 nm
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Quantum State-to-State Vacuum Ultraviolet Photodissociation Dynamics of Small Molecules
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Single-Atom Protecting Group for on-Surface Synthesis of Graphdiyne Nanowires
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Energy Transfer and Electron Transfer in Composite System of Carbon Quantum Dots/Rhodamine B Molecules
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Iterative Multireference Con guration Interaction
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Metal-Organic Frameworks Derived Ag-CoSO4 Nanohybrids as Efficient Electrocatalyst for Oxygen Evolution Reaction
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Near Ambient Pressure Adsorption of Nickel Carbonyl Contaminated CO on Cu(111) Surface
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Direct Z-scheme CdS-CdS Nanorod Arrays Photoanode: Synthesis, Characterization and Photoelectrochemical Performance
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Selective Oxidation of Aldehyde over Hydroxymethyl Group Catalyzed by Gold Nanoparticles in Aqueous Phase
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Effect of Sulfate Adlayer on Formic Acid Oxidation on Pd(111) Electrode
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Density Functional Theory and Electrochemistry Studies on LiFexMn1-xPO4 Solid Solutions
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Effect of Sample Temperature on Radiation Characteristics of Nanosecond Laser-Induced Soil Plasma
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Ab Initio Calculation on Spectroscopic Properties and Radiative Lifetimes of Low-Lying Excited States of NaK
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Influence of Neighboring Layers on Interfacial Energy of Adjacent Layers
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Near-Field Scattering Enhancement of Perylene Based Aggregates for Random Lasing
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Computational Study on Interactions between CO2 and (TiO2)n Clusters at Specific Sites
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Optical Spectroscopy of Pr3+ Ion Singly Doped LiLuF4 Single Crystal by Bridgman Method
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Bio-syngas Converting to Liquid Fuels over Co Modified Fe3O4-MnO2 Catalysts
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Redox Controllable Switch of Crystalline Phase and Physical Property in SrVOx Epitaxial Films
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Chinese Abstracts
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Temperature-Dependent Formation of Redox Sites in Molybdenum Trioxide Studied by Electron Paramagnetic Resonance Spectroscopy
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Dark Color ZnO Quasi-One-Dimensional Nanostructures Grown by Hydrothermal Method and Modulation of their Optical Properties
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Content
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Preparation of Li4Ti5O12 Microspheres with a Pure Cr2O3 Coating Layer and its Effect for Lithium Storage
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A Double Network Hydrogel with High Mechanical Strength and Shape Memory Properties
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Anomalous and Normal Diffusion of Tracers in Crowded Environments: E ect of Size Disparity between Tracer and Crowders
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Two Step Chemical Vapor Deposition of In2Se3/MoSe2 van der Waals Heterostructures
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Ultrafast Electron Transfer with Symmetrical Quasi-classical Dynamics based on Mapping Hamiltonian and Quantum Dynamics based on ML-MCTDH
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Infrared Spectra, Structures and Bonding of Binuclear Transition Metal Carbonyl Cluster Ions
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Dissipaton Equation of Motion Theory versus Fokker-Planck Quantum Master Equation
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A High-Performance and Flexible Chemical Structure & Data Search Engine Built on CouchDB & ElasticSearch
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Identification of Superoxide O2- during Thermal Decomposition of Molten KNO3-NaNO2-NaNO3 Salt by Electron Paramagnetic Resonance and UV-Vis Absorption Spectroscopy
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Photodissociation Dynamics of Carbon Dioxide Cation via the Vibrationally Mediated Ã2Πu,1/2 State: A Time-Sliced Velocity-Mapped Ion Imaging Study
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Raman and Infrared Spectra for All-trans-astaxanthin in Dimethyl Sulfoxide Solvent
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Synthesis of Higher Alcohols from Syngas over Alkali Promoted K-Co-Mo Catalysts Supported on Multi-walled Carbon Nanotubes
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Paclitaxel Hydrogelator Delays Microtubule Aggregation
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Surface Plasmon Assisted Directional Rayleigh Scattering
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g-C3N4/SnS2 Heterostructure: a Promising Water Splitting Photocatalyst
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Quantum Dynamics of Oxyhydrogen Complex-Forming Reactions for the HO2 and HO3 Systems
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γ-Ray Irradiation-Derived MnO/rGO Composites for High Performance Lithium Ion Batteries
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Maximum Thermodynamic Electrical Efficiency of Fuel Cell System and Results for Hydrogen, Methane, and Propane Fuels
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Preparation of Organic Nanoacid Catalyst for Urethane Formation
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TiO2/BiVO4, a Heterojuncted Microfiber with Enhanced Photocatalytic Performance for Methylene Blue under Visible Light Irradiation
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Bimetallic RuM (M=Co, Ni) Alloy NPs Supported on MIL-110(Al): Synergetic Catalysis in Hydrolytic Dehydrogenation of Ammonia Borane
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Contacted Ion Pairs in Aqueous CuCl2 by the Combination of Ratio Spectra, Difference Spectra, Second Order Difference Spectra in the UV-Visible Spectra
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Low-Storage Runge-Kutta Method for Simulating Time-Dependent Quantum Dynamics
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Effect of a Single Repeat Sequence of the Human Telomere d(TTAGGG) on Structure of Single-Stranded Telomeric DNA d[AGGG(TTAGGG)6]
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Molecular Dynamics Simulation Study of ClF in Water: Halogen Bonding Interaction in Liquid
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Molecular Dynamics Study of Hydrogen Dissociation on Pd Surfaces using Reactive Force Fields
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Electrochemical Preparation of Polypyrrole/Graphene Films on Titanium Mesh as Active Materials for Supercapacitors
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Experimental and Density Functional Theory Calculation Studies on Raman and Infrared Spectra of 1,1'-Binaphthyl-2,2'-diamine
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Recent Advances in Multifunctional Capsule Catalysts in Heterogeneous Catalysis
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Intermolecular Interactions in Self-Assembly Process of Sodium Dodecyl Sulfate by Vertically Polarized Raman Spectra
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Phosphorescent Cationic Iridium (III) Complexes with 1,3,4-Oxadiazole Cyclometalating Ligands:Solvent-Dependent Excited-State Dynamics
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Theories and Applications of Mixed Quantum-Classical Non-adiabatic Dynamics
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Superparticles Formed by Amphiphilic Tadpole-like Single Chain Polymeric Nanoparticles and Their Application as an Ultrasonic Responsive Drug Carrier
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Narrow Band Gap and Roomtemperature Ferromagnetism in KNb1-xFexO3-δ
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Tailoring Oxygen Vacancy on Co3O4 Nanosheets with High Surface Area for Oxygen Evolution Reaction
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Influence of Poly (methyl metacrylate) Addition on Resistive Switching Performance of P3HT/P(VDF-TrFE) Blend Films
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Influence of Electron Donating Ability on Reverse Intersystem Crossing Rate for One Kind of Thermally Activated Delayed Fluorescence Molecules
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π-Electron-Assisted Relaxation of Spin Excited States in Cobalt Phthalocyanine Molecules on Au(111) Surface
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Numerical Investigation on 1,3-Butadiene/Propyne Co-pyrolysis and Insight into Synergistic Effect on Aromatic Hydrocarbon Formation
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Real-Time Observation of Pyoverdine Dissolving Ferric Hydroxide
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Comparison of Adsorption of Proteins at Di erent Sizes on Pristine Graphene and Graphene Oxide
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Modification of Surface Reactivity by CO: Effects on Decomposition and Polymerization of Acetaldehyde on Ru(0001)
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Chemoselective Transfer Hydrogenation of Cinnamaldehyde over Activated Charcoal Supported Pt/Fe3O4 Catalyst
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Experimental and Theoretical Study on Dissociative Photoionization of Cyclopentanone
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A New kHz Velocity Map Ion/Electron Imaging Spectrometer for Femtosecond Time-Resolved Molecular Reaction Dynamics Studies
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Catalytic Performance of Graphite Oxide Supported Au Nanoparticles in Aerobic Oxidation of Benzyl Alcohol: Support Effect
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Diffusion of Formaldehyde on Rutile TiO2(110) Assisted by Surface Hydroxyl Groups
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Efficient Mass Transport and Electrochemistry Coupling Scheme for Reliable Multiphysics Modeling of Planar Solid Oxide Fuel Cell Stack
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Accelerating the Construction of Neural Network Potential Energy Surfaces: A Fast Hybrid Training Algorithm
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Field Measurement of NO2 and RNO2 by Two-Channel Thermal Dissociation Cavity Ring Down Spectrometer
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γ-Ray-Radiation-Scissioned Chitosan as a Gene Carrier and Its Improved in uitro Gene Transfection Performance
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Crossed Molecular Beam Study of H+CH4 and H+CD4 Reactions: Vibrationally Excited CH3/CD3 Product Channels
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Effects of Shape of Crowders on Dynamics of a Polymer Chain Closure
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Direct Vibrational Energy Transfer in Monomeric Water Probed with Ultrafast Two Dimensional Infrared Spectroscopy
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Theoretical Investigation on Photoionization and Dissociative Photoionization of Toluene
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Single Pt Atoms Supported on Oxidized Graphene as a Promising Catalyst for Hydrolysis of Ammonia Borane
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DFT+U Analysis on Stability of Low-Index Facets in Hexagonal LaCoO3 Perovskite:Effect of Co3+ Spin States
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Highly Responsive and Selective Ethanol Gas Sensor Based on Co3O4-Modified SnO2 Nanofibers
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Theoretical Study of Isoprene Dissociative Photoionization
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FeOx Coating on Pd/C Catalyst by Atomic Layer Deposition Enhances the Catalytic Activity in Dehydrogenation of Formic Acid
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Hidden Relaxation Channels in Aqueous Methylene Blue after Functionalization of Graphene Oxide Probed by Transient Absorption Spectroscopy
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Long-Lived Coherence Originating from Electronic-Vibrational Couplings in Light-Harvesting Complexes
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Clustering Algorithms to Analyze Molecular Dynamics Simulation Trajectories for Complex Chemical and Biological Systems
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Acetone Formation from Photolysis of 2-Propanol on Anatase-TiO2(101)
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Quasiparticle Band Structures of Defects in Anatase TiO2 Bulk
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High Resolution Synchrotron Diffraction Study on Charge Density Distribution of Ampicillin Trihydrate
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Infrared Spectra and Theoretical Calculations of BS2 and BS2-: Strong Pseudo Jahn-Teller Effect
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Coherent Exciton-Phonon Coupling in CdSe/ZnS Nanocrystals Studied by Two-Dimensional Electronic Spectroscopy
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Two Rhodamine-based Turn on Chemosensors with High Sensitivity, Selectivity, and Naked-Eye Detection for Hg2+
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Magnetic-Bottle and Velocity-Map Imaging Photoelectron Spectroscopy of APS- (A=C14H10 or Anthracene): Electron Structure, Spin-Orbit Coupling of APS·, and Dipole-Bound State of APS-