Electron Transfer Dynamics from CsPbBr3 Nanocrystals to Au144 Clusters [0.03%]
铯铅卤钙钛矿纳米晶到Au144簇的电子转移动力学研究
Kritiman Marjit,Goutam Ghosh,Srijon Ghosh et al.
Kritiman Marjit et al.
Lead halide perovskite nanocrystals have received significant attention as an absorber material for designing efficient optoelectronic devices. The fundamental understanding of the hot carrier (HC) dynamics as well as its extraction in hybr...
Voltage Imaging with Engineered Proton-Pumping Rhodopsins: Insights from the Proton Transfer Pathway [0.03%]
通过工程化质子泵视紫红质进行电压成像：来自质子转移途径的见解
Xin Meng,Srividya Ganapathy,Lars van Roemburg et al.
Xin Meng et al.
Voltage imaging using genetically encoded voltage indicators (GEVIs) has taken the field of neuroscience by storm in the past decade. Its ability to create subcellular and network level readouts of electrical dynamics depends critically on ...
Development of Two-Dimensional Electronic-Vibrational Sum Frequency Generation (2D-EVSFG) for Vibronic and Solvent Couplings of Molecules at Interfaces and Surfaces [0.03%]
二维电子-振动和频生成(2D-EVSFG)的发展：用于研究界面和表面分子的 vibronic 和溶剂耦合
Zhi-Chao Huang-Fu,Yuqin Qian,Gang-Hua Deng et al.
Zhi-Chao Huang-Fu et al.
Many photoinduced excited states' relaxation processes and chemical reactions occur at interfaces and surfaces, including charge transfer, energy transfer, proton transfer, proton-coupled electron transfer, configurational dynamics, conical...
Ionic Field Screening in MAPbBr3 Crystals Revealed from Remnant Sensitivity in X-ray Detection [0.03%]
基于X射线探测残余效应的MAPbBr3晶体中离子场屏蔽性质的研究
Agustin O Alvarez,Ferdinand Lédée,Marisé García-Batlle et al.
Agustin O Alvarez et al.
Research on metal halide perovskites as absorbers for X-ray detection is an attractive subject due to the optimal optoelectronic properties of these materials for high-sensitivity applications. However, the contact degradation and the long-...
Characteristic Activity Parameters of Electron Donors and Electron Acceptors [0.03%]
电子供体和电子受体的特征活性参数
Jin-Ye Zhang,Li-Li Wang,Xiao-Qing Zhu
Jin-Ye Zhang
It is well-known that for an electron transfer reaction, the electron-donating ability of electron donors and the electron-accepting ability of electron acceptors can be quantitatively described by the oxidation potential of electron donors...
The Structure of Density-Potential Mapping. Part I: Standard Density-Functional Theory [0.03%]
密度-势能映射的结构（一）：标准密度泛函理论
Markus Penz,Erik I Tellgren,Mihály A Csirik et al.
Markus Penz et al.
The Hohenberg-Kohn theorem of density-functional theory (DFT) is broadly considered the conceptual basis for a full characterization of an electronic system in its ground state by just the one-body particle density. Part I of this review ai...
Dynamics of Interlayer Na-Ions in Ga-Substituted Na2Zn2TeO6 (NZTO) Studied by Variable-Temperature Solid-State 23Na NMR Spectroscopy and DFT Modeling [0.03%]
采用变温固态钠核磁共振和DFT计算研究镓掺杂的Na2Zn2TeO6(NZTO)中层间Na离子的动力学行为
Frida Sveen Hempel,Charlotte Martineau-Corcos,Federico Bianchini et al.
Frida Sveen Hempel et al.
Local Na-coordination and dynamics of Na2-xZn2-xGaxTeO6; x = 0.00 (NZTO), 0.05, 0.10, 0.15, 0.20, were studied by variable-temperature, 23Na NMR methods and DFT AIMD simulations. Structure and dynamics were probed by NMR in the temperature ...
The Bethe-Salpeter QED Wave Equation for Bound-State Computations of Atoms and Molecules [0.03%]
原子和分子束缚态的Bethe-Salpeter量子电动力学波函数方程计算理论
Edit Mátyus,Dávid Ferenc,Péter Jeszenszki et al.
Edit Mátyus et al.
Interactions in atomic and molecular systems are dominated by electromagnetic forces and the theoretical framework must be in the quantum regime. The physical theory for the combination of quantum mechanics and electromagnetism, quantum ele...
Practical Considerations for Simulating the Plasmonic Properties of Metal Nanoparticles [0.03%]
模拟金属纳米粒子等离子体性质的若干实际问题分析
Jack S Googasian,Sara E Skrabalak
Jack S Googasian
Simulating the plasmonic properties of colloidally derived metal nanoparticles with accuracy to their experimentally observed measurements is challenging due to the many structural and compositional parameters that influence their scatterin...
Nanointerfaces: Concepts and Strategies for Optical and X-ray Spectroscopic Characterization [0.03%]
纳米界面：光学和X射线光谱表征的概念与策略
Tristan Petit,Mailis Lounasvuori,Arsène Chemin et al.
Tristan Petit et al.
Interfaces at the nanoscale, also called nanointerfaces, play a fundamental role in physics and chemistry. Probing the chemical and electronic environment at nanointerfaces is essential in order to elucidate chemical processes relevant for ...