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TIB-Lesesaalbestand
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Electronic Structure of Semiconducting and Metallic Tubes in TiO2/Carbon Nanotube Heterojunctions: Density Functional Theory Calculations
American Chemical Society | 2013| -
Rapid Charge Separation Boosts Solar Hydrogen Generation at the Graphene–MoS2 Junction: Time-Domain Ab Initio Analysis
American Chemical Society | 2021| -
Anomalous Temperature-Dependent Charge Recombination in CH3NH3PbI3 Perovskite: Key Roles of Charge Localization and Thermal Effect
American Chemical Society | 2019| -
Quantum Coherence Facilitates Efficient Charge Separation at a MoS2/MoSe2 van der Waals Junction
American Chemical Society | 2016| -
Oxidation Notably Accelerates Nonradiative Electron–Hole Recombination in MoS2 by Different Mechanisms: Time-Domain Ab Initio Analysis
American Chemical Society | 2020| -
Unravelling the Effects of Pressure-Induced Suppressed Electron–Hole Recombination in CsPbBr3 Perovskite: Time-Domain ab Initio Analysis
American Chemical Society | 2019| -
Hole Localization Inhibits Charge Recombination in Tin–Lead Mixed Perovskites: Time–Domain ab Initio Analysis
American Chemical Society | 2019| -
Photoinduced Anomalous Electron Transfer Dynamics at a Lateral MoS2–Graphene Covalent Junction
American Chemical Society | 2021| -
Quantum Coherence Facilitates Efficient Charge Separation at a MoS2/MoSe2 van der Waals Junction
Online Contents | 2016| -
Rapid Decoherence Induced by Light Expansion Suppresses Charge Recombination in Mixed Cation Perovskites: Time-Domain ab Initio Analysis
American Chemical Society | 2020| -
Benign Effects of Twin Boundaries on Charge Carrier Lifetime in Metal Halide Perovskites by a Time-Domain Study
American Chemical Society | 2021| -
Isotopic Exchange Extends Charge Carrier Lifetime in Metal Lead Perovskites by Quantum Dynamics Simulations
American Chemical Society | 2020| -
Charge-Compensated Doping Extends Carrier Lifetimes in SrTiO3 by Passivating Oxygen Vacancy Defects
American Chemical Society | 2021| -
Instantaneous Generation of Charge-Separated State on TiO2 Surface Sensitized with Plasmonic Nanoparticles
American Chemical Society | 2014| -
Dopants Control Electron–Hole Recombination at Perovskite–TiO2 Interfaces: Ab Initio Time-Domain Study
American Chemical Society | 2015| -
Asymmetry in the Electron and Hole Transfer at a Polymer–Carbon Nanotube Heterojunction
Online Contents | 2014| -
Photoinduced Small Hole Polarons Formation and Recombination in All-Inorganic Perovskite from Quantum Dynamics Simulation
American Chemical Society | 2022| -
Thermal-Driven Dynamic Shape Change of Bimetallic Nanoparticles Extends Hot Electron Lifetime of Pt/MoS2 Catalysts
American Chemical Society | 2021| -
Density Functional Theory Half-Electron Self-Energy Correction for Fast and Accurate Nonadiabatic Molecular Dynamics
American Chemical Society | 2021| -
Unveiling the Valence State of Interstitial Bromine on Charge Carrier Lifetime in CH3NH3PbBr3 by Quantum Dynamics Simulation
American Chemical Society | 2022| -
Asymmetry in the Electron and Hole Transfer at a Polymer–Carbon Nanotube Heterojunction
American Chemical Society | 2014| -
Time-Domain ab Initio Modeling of Electron–Phonon Relaxation in High-Temperature Cuprate Superconductors
American Chemical Society | 2017| -
Substitutional alkaline earth metals delay nonradiative charge recombination in CH3NH3PbI3 perovskite: A time-domain study
American Institute of Physics | 2022| -
Time-Domain Ab Initio Analysis of Excitation Dynamics in a Quantum Dot/Polymer Hybrid: Atomistic Description Rationalizes Experiment
American Chemical Society | 2015| -
Ab Initio Nonadiabatic Molecular Dynamics of the Ultrafast Electron Injection from a PbSe Quantum Dot into the TiO2 Surface
American Chemical Society | 2011| -
Ab Initio Nonadiabatic Molecular Dynamics of Ultrafast Demagnetization in Iron
American Chemical Society | 2023| -
Atomic Model for Alkali Metal-Doped Tin–Lead Mixed Perovskites: Insight from Quantum Dynamics
American Chemical Society | 2023| -
Nonadiabatic Molecular Dynamics with Non-Condon Effect of Charge Carrier Dynamics
American Chemical Society | 2024| -
Electronic properties of F/Zr co-doped anatase TiO2 photocatalysts from GGA+ U calculations
Online Contents | 2010| -
Nuclear Quantum Effects Accelerate Charge Recombination but Boost the Stability of Inorganic Perovskites in Mild Humidity
American Chemical Society | 2024| -
The sp3 Defect Decreases Charge Carrier Lifetime in (8,3) Single-Walled Carbon Nanotubes
American Chemical Society | 2023| -
Spin–Orbit Coupling Notably Retards Non-radiative Electron–Hole Recombination in Methylammonium Lead Triiodide Perovskites
American Chemical Society | 2023|
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