相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。In Situ Confocal Raman Microscopy of Redox Polymer Films on Bulk Electrode Supports
Jiahe Xu et al.
ACS MEASUREMENT SCIENCE AU (2023)
TDDFT Investigation of the Raman and Resonant Raman Spectra of Fluorescent Protein Chromophore Models
Freddy Zutterman et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2022)
Efficient simulation of resonance Raman spectra with tight-binding approximations to density functional theory
Sahar Ashtari-Jafari et al.
JOURNAL OF CHEMICAL PHYSICS (2022)
In Situ Surface-enhanced Raman Scattering Spectroscopic Study of a Redox-active Deformable Hydrogel on a Roughened Au Electrode Surface
Bo Wang et al.
CHEMISTRY LETTERS (2021)
Adapting confocal Raman microscopy for in situ studies of redox transformations at electrode-electrolyte interfaces
Carol Korzeniewski et al.
JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2021)
Pseudocapacitive Redox Polymers as Battery Materials: A Proof-of-Concept All-Polymer Aqueous Battery
Stefan Dieckhoefer et al.
CHEMELECTROCHEM (2021)
Bioelectrocatalysis as the basis for the design of enzyme-based biofuel cells and semi-artificial biophotoelectrodes
Adrian Ruff et al.
NATURE CATALYSIS (2020)
Time-Resolved Resonant Raman Spectroscopy of the Photoinduced Electron Transfer from Ruthenium(II) Trisbipyridine to Methyl Viologen
Mark Hammonds et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2020)
The ORCA quantum chemistry program package
Frank Neese et al.
JOURNAL OF CHEMICAL PHYSICS (2020)
Extended Operational Lifetime of a Photosystem-Based Bioelectrode
Fangyuan Zhao et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2019)
Efficient simulation of overtones and combination bands in resonant Raman spectra
Bernardo de Souza et al.
JOURNAL OF CHEMICAL PHYSICS (2019)
Viologen-based electrochromic materials and devices
Kanagaraj Madasamy et al.
JOURNAL OF MATERIALS CHEMISTRY C (2019)
On the theoretical prediction of fluorescence rates from first principles using the path integral approach
Bernardo de Souza et al.
JOURNAL OF CHEMICAL PHYSICS (2018)
Nafion particles doped with methyl viologen: electrochemistry
Haiying Yang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2018)
A gas breathing hydrogen/air biofuel cell comprising a redox polymer/hydrogenase-based bioanode
Julian Szczesny et al.
NATURE COMMUNICATIONS (2018)
Wiring of PhotosystemI and Hydrogenase on an Electrode for Photoelectrochemical H2 Production by using Redox Polymers for Relatively Positive Onset Potential
Cristina Tapia et al.
CHEMELECTROCHEM (2017)
Comparative assessment of density functional methods for evaluating essential parameters to simulate SERS spectra within the excited state energy gradient approximation
Mozhdeh Mohammadpou et al.
JOURNAL OF CHEMICAL PHYSICS (2016)
A general time-dependent route to Resonance-Raman spectroscopy including Franck-Condon, Herzberg-Teller and Duschinsky effects
Alberto Baiardi et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
New tools for the systematic analysis and visualization of electronic excitations. I. Formalism
Felix Plasser et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
Analysis of the Resonant Raman Spectra of Viologens and of Their Radical Cations Using Range-Separated Hybrid Density Functionals
Julia Romanova et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2014)
A redox hydrogel protects hydrogenase from high-potential deactivation and oxygen damage
Nicolas Plumere et al.
NATURE CHEMISTRY (2014)
Resonant Raman spectra of molecules with diradical character: multiconfigurational wavefunction investigation of neutral viologens
Julia Romanova et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Polyviologen Hydrogel with High-Rate Capability for Anodes toward an Aqueous Electrolyte-Type and Organic-Based Rechargeable Device
Naoki Sano et al.
ACS APPLIED MATERIALS & INTERFACES (2013)
Unprecedented stacking of MV2+ dications and MV•+ radical cations in the mixed-valence viologen salt (MV)2(BF4)3 (MV = methylviologen)
Nicolas Leblanc et al.
CHEMICAL COMMUNICATIONS (2013)
Long-Range Corrected Hybrid Density Functionals with Improved Dispersion Corrections
You-Sheng Lin et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Simulating One-Photon Absorption and Resonance Raman Scattering Spectra Using Analytical Excited State Energy Gradients within Time-Dependent Density Functional Theory
Daniel W. Silverstein et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Analysis of Excitonic and Charge Transfer Interactions from Quantum Chemical Calculations
Felix Plasser et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Comparison of vertical and adiabatic harmonic approaches for the calculation of the vibrational structure of electronic spectra
Francisco Jose Avila Ferrer et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)
Novel Color-Reinforcing Electrochromic Device Based on Surface-Confined Ruthenium Purple and Solution-Phase Methyl Viologen
Roger J. Mortimer et al.
CHEMISTRY OF MATERIALS (2011)
Time dependent density functional theory investigation of the resonance Raman properties of the julolidinemalononitrile push-pull chromophore in various solvents
Julien Guthmuller et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Quantum mechanical continuum solvation models
J Tomasi et al.
CHEMICAL REVIEWS (2005)
Geometry optimizations with the coupled-cluster model CC2 using the resolution-of-the-identity approximation
C Hättig
JOURNAL OF CHEMICAL PHYSICS (2003)
Natural transition orbitals
RL Martin
JOURNAL OF CHEMICAL PHYSICS (2003)
Quantum chemical calculation of vibrational spectra of large molecules - Raman and IR spectra for buckminsterfullerene
J Neugebauer et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2002)
Simulations of vibronic profiles in two-photon absorption
P Macak et al.
CHEMICAL PHYSICS LETTERS (2000)