On the public citation graph
Quantum Dynamical Simulations as a Tool for Predicting Photoinjection Mechanisms in Dye-Sensitized TiO 2 Solar Cells
0 signed · 118 inferred · view as graph
Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.
Is this your work? Sign in with ORCID and put your name on the
claims that are yours.
Reference health. See whether every reference in this work resolves to a
known work and none has been retracted — and get a dated CiteStamped
badge you can embed.
What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/adfm.200500573openalex-snapshot
Hybrid Solar Cells from Regioregular Polythiophene and ZnO Nanoparticles
inferredcites →https://doi.org/10.1007/978-3-642-04937-8openalex-snapshot
Interfacial Electrochemistry
inferredcites →https://doi.org/10.1016/j.cplett.2009.05.019openalex-snapshot
Time-dependent density functional theory study of squaraine dye-sensitized solar cells
inferredcites →https://doi.org/10.1016/j.cplett.2010.05.064openalex-snapshot
Direct vs. indirect injection mechanisms in perylene dye-sensitized solar cells: A DFT/TDDFT investigation
inferredcites →https://doi.org/10.1021/ar900034topenalex-snapshot
Large π-Aromatic Molecules as Potential Sensitizers for Highly Efficient Dye-Sensitized Solar Cells
inferredcites →https://doi.org/10.1021/ar900141yopenalex-snapshot
Recent Advances in Sensitized Mesoscopic Solar Cells
inferredcites →https://doi.org/10.1021/ct900422copenalex-snapshot
An Improved Self-Consistent-Charge Density-Functional Tight-Binding (SCC-DFTB) Set of Parameters for Simulation of Bulk and Molecular Systems Involving Titanium
inferredcites →https://doi.org/10.1021/ic0508371openalex-snapshot
Solar Energy Conversion by Dye-Sensitized Photovoltaic Cells
inferredcites →https://doi.org/10.1021/ja01167a004openalex-snapshot
The Ultraviolet Absorption Spectra of Some Hydroxynaphthalenes
inferredcites →https://doi.org/10.1021/ja0346330openalex-snapshot
Quantum Dynamics Simulations of Interfacial Electron Transfer in Sensitized TiO 2 Semiconductors
inferredcites →https://doi.org/10.1021/ja042156vopenalex-snapshot
AbInitioNonadiabatic Molecular Dynamics of the Ultrafast Electron Injection across the Alizarin−TiO2Interface
inferredcites →https://doi.org/10.1021/ja052467lopenalex-snapshot
Combined Experimental and DFT-TDDFT Computational Study of Photoelectrochemical Cell Ruthenium Sensitizers
inferredcites →https://doi.org/10.1021/ja800268xopenalex-snapshot
Temperature Independence of the Photoinduced Electron Injection in Dye-Sensitized TiO2 Rationalized by Ab Initio Time-Domain Density Functional Theory
inferredcites →https://doi.org/10.1021/ja805498wopenalex-snapshot
Acetylacetonate Anchors for Robust Functionalization of TiO2Nanoparticles with Mn(II)−Terpyridine Complexes
inferredcites →https://doi.org/10.1021/ja9002684openalex-snapshot
New Paradigm in Molecular Engineering of Sensitizers for Solar Cell Applications
inferredcites →https://doi.org/10.1021/jo100762topenalex-snapshot
Organic Dyes Containing Coplanar Diphenyl-Substituted Dithienosilole Core for Efficient Dye-Sensitized Solar Cells
inferredcites →https://doi.org/10.1021/jp011078kopenalex-snapshot
Dynamics of Back-Electron Transfer Processes of Strongly Coupled Triphenyl Methane Dyes Adsorbed on TiO2 Nanoparticle Surface as Studied by Fast and Ultrafast Visible Spectroscopy
inferredcites →https://doi.org/10.1021/jp026963xopenalex-snapshot
Molecular Design of Coumarin Dyes for Efficient Dye-Sensitized Solar Cells
inferredcites →https://doi.org/10.1021/jp031118fopenalex-snapshot
Quantitative Estimation of the Efficiency of Electron Injection from Excited Sensitizer Dye into Nanocrystalline ZnO Film
inferredcites →https://doi.org/10.1021/jp034935oopenalex-snapshot
Comparison of Electron Transfer Dynamics in Molecule-to-Nanoparticle and Intramolecular Charge Transfer Complexes
inferredcites →https://doi.org/10.1021/jp046342zopenalex-snapshot
Electronic Structure and Spectra of Catechol and Alizarin in the Gas Phase and Attached to Titanium
inferredcites →https://doi.org/10.1021/jp0513263openalex-snapshot
Lithium Ion Effect on Electron Injection from a Photoexcited Coumarin Derivative into a TiO2 Nanocrystalline Film Investigated by Visible-to-IR Ultrafast Spectroscopy
inferredcites →https://doi.org/10.1021/jp052570xopenalex-snapshot
Nonadiabatic Molecular Dynamics Study of Electron Transfer from Alizarin to the Hydrated Ti4+ Ion
inferredcites →https://doi.org/10.1021/jp0537411openalex-snapshot
A Strategy To Increase the Efficiency of the Dye-Sensitized TiO2 Solar Cells Operated by Photoexcitation of Dye-to-TiO2 Charge-Transfer Bands
inferredcites →https://doi.org/10.1021/jp070186popenalex-snapshot
DFTB+, a Sparse Matrix-Based Implementation of the DFTB Method
inferredcites →https://doi.org/10.1021/jp201233yopenalex-snapshot
Direct vs Indirect Mechanisms for Electron Injection in Dye-Sensitized Solar Cells
inferredcites →https://doi.org/10.1021/jp203826qopenalex-snapshot
Transition Dipole Moments of the Qy Band in Photosynthetic Pigments
inferredcites →https://doi.org/10.1021/jp210248kopenalex-snapshot
Quantum Dynamics of Light-Induced Charge Injection in a Model Dye–Nanoparticle Complex
inferredcites →https://doi.org/10.1021/jp810201copenalex-snapshot
A Study of the Interactions between I−/I3− Redox Mediators and Organometallic Sensitizing Dyes in Solar Cells
inferredcites →https://doi.org/10.1021/jp903966nopenalex-snapshot
Interfacial Electron Transfer in TiO2Surfaces Sensitized with Ru(II)−Polypyridine Complexes
inferredcites →https://doi.org/10.1021/jp909232bopenalex-snapshot
Preparation and Spectral, Electrochemical, and Photovoltaic Properties of Acene-Modified Zinc Porphyrins
inferredcites →https://doi.org/10.1021/jp910972xopenalex-snapshot
Kinetic Competition in a Coumarin Dye-Sensitized Solar Cell: Injection and Recombination Limitations upon Device Performance
inferredcites →https://doi.org/10.1021/jp912133ropenalex-snapshot
Comparison of Electron-Transfer Dynamics from Coumarin 343 to TiO 2 , SnO 2 , and ZnO Nanocrystalline Thin Films: Role of Interface-Bound Charge-Separated Pairs
inferredcites →https://doi.org/10.1021/jz1005225openalex-snapshot
Beyond the Adiabatic Limit: Charge Photogeneration in Organic Photovoltaic Materials
inferredcites →https://doi.org/10.1021/nl061173aopenalex-snapshot
Dye-Sensitized Solar Cells Incorporating a “Liquid” Hole-Transporting Material
inferredcites →https://doi.org/10.1021/ol802630xopenalex-snapshot
Structurally Simple Dipolar Organic Dyes Featuring 1,3-Cyclohexadiene Conjugated Unit for Dye-Sensitized Solar Cells
inferredcites →https://doi.org/10.1038/353737a0openalex-snapshot
A low-cost, high-efficiency solar cell based on dye-sensitized colloidal TiO2 films
inferredcites →https://doi.org/10.1039/b407860hopenalex-snapshot
State selective electron injection in non-aggregated titanium phthalocyanine sensitised nanocrystalline TiO 2 films
inferredcites →https://doi.org/10.1039/b804321nopenalex-snapshot
Photodriven heterogeneous charge transfer with transition-metal compounds anchored to TiO 2 semiconductor surfaces
inferredcites →https://doi.org/10.1039/b910241hopenalex-snapshot
Hydroxamate anchors for water-stable attachment to TiO2 nanoparticles
inferredcites →https://doi.org/10.1039/b926051jopenalex-snapshot
Dynamical simulation of the optical response of photosynthetic pigments
inferredcites →https://doi.org/10.1088/0957-4484/15/9/008openalex-snapshot
Poly(3-hexylthiophene):TiO2nanocomposites for solar cell applications
inferredcites →https://doi.org/10.1088/0957-4484/19/42/424002openalex-snapshot
Alignment of the dye’s molecular levels with the TiO 2 band edges in dye-sensitized solar cells: a DFT–TDDFT study
inferredcites →https://doi.org/10.1093/oso/9780198529798.003.0021openalex-snapshot
Chemical Reactions In Condensed Phases
inferredcites →https://doi.org/10.1103/physrevb.54.4484openalex-snapshot
Time-dependent local-density approximation in real time
inferredcites →https://doi.org/10.1103/physrevb.58.7260openalex-snapshot
Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties
inferredcites →https://doi.org/10.1146/annurev.physchem.55.091602.094347openalex-snapshot
ULTRAFAST ELECTRON TRANSFER AT THE MOLECULE-SEMICONDUCTOR NANOPARTICLE INTERFACE
inferredcites →https://doi.org/10.1146/annurev.physchem.58.052306.144054openalex-snapshot
Theoretical Studies of Photoinduced Electron Transfer in Dye-Sensitized TiO 2
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.2139/ssrn.4679482openalex-extracted
First Principles Studies of Some Polymer-Pcbm Complexes for Pv Cells
inferred← citeshttps://doi.org/10.1002/9781119625933.ch2openalex-snapshot
Density Functional Tight Binding Calculations for Probing Electronic‐Excited States of Large Systems
inferred← citeshttps://doi.org/10.1002/jcc.24751openalex-snapshot
Theoretical rationalization for reduced charge recombination in bulky carbazole‐based sensitizers in solar cells
inferred← citeshttps://doi.org/10.1002/qua.25514openalex-snapshot
Density‐functional theory study of the interaction mechanism and optical properties of flavonols on the boron nitride nanotubes
inferred← citeshttps://doi.org/10.1007/s00214-018-2229-9openalex-snapshot
Energy conversion process of substituted phthalocyanines with potential application to DSSC: a theoretical study
inferred← citeshttps://doi.org/10.1007/s00894-016-2976-2openalex-snapshot
Does the position of the electron-donating nitrogen atom in the ring system influence the efficiency of a dye-sensitized solar cell? A computational study
inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.13002-1openalex-snapshot
Semiconductor/Metal (Oxide) Hybrid Materials for Applications in Photocatalysis
inferred← citeshttps://doi.org/10.1016/b978-0-12-814541-8.00005-7openalex-snapshot
Linear-Response and Real-Time, Time-Dependent Density Functional Theory for Predicting Optoelectronic Properties of Dye-Sensitized Solar Cells
inferred← citeshttps://doi.org/10.1016/j.bioelechem.2014.05.002openalex-snapshot
Bioelectrochemical sensing of promethazine with bamboo-type multiwalled carbon nanotubes dispersed in calf-thymus double stranded DNA
inferred← citeshttps://doi.org/10.1016/j.comptc.2022.113681openalex-snapshot
Computational design of a nanoconjugate model of pyrene-linked CdTe quantum dot for the detection of trinitrotoluene
inferred← citeshttps://doi.org/10.1016/j.dyepig.2013.02.008openalex-snapshot
Density functional theory characterization and verification of high-performance indoline dyes with D–A–π–A architecture for dye-sensitized solar cells
inferred← citeshttps://doi.org/10.1016/j.dyepig.2023.111495openalex-snapshot
Exploring the impact of structural rigidification of amino-substituted bio-inspired flavylium dyes in DSSCs
inferred← citeshttps://doi.org/10.1016/j.jpcs.2024.111932openalex-snapshot
First principles studies of some polymer–PCBM complexes for PV cells
inferred← citeshttps://doi.org/10.1016/j.mtener.2020.100571openalex-snapshot
Absorption mechanism of dopamine/DOPAC-modified TiO2 nanoparticles by time-dependent density functional theory calculations
inferred← citeshttps://doi.org/10.1016/j.solener.2016.12.023openalex-snapshot
Simulation of natural dyes adsorbed on TiO2 for photovoltaic applications
inferred← citeshttps://doi.org/10.1016/j.solener.2021.06.051openalex-snapshot
Experimental and DFT study of natural curcumin derived dyes as n-type sensitizers
inferred← citeshttps://doi.org/10.1021/acs.chemrev.0c00223openalex-snapshot
Real-Time Time-Dependent Electronic Structure Theory
inferred← citeshttps://doi.org/10.1021/acs.jctc.5b01019openalex-snapshot
Real-Time Quantum Dynamics Reveals Complex, Many-Body Interactions in Solvated Nanodroplets
inferred← citeshttps://doi.org/10.1021/acs.jctc.7b01150openalex-snapshot
Correction to Real-Time Quantum Dynamics of Long-Range Electronic Excitation Transfer in Plasmonic Nanoantennas
inferred← citeshttps://doi.org/10.1021/acs.jctc.9b01217openalex-snapshot
A Real-Time Time-Dependent Density Functional Tight-Binding Implementation for Semiclassical Excited State Electron–Nuclear Dynamics and Pump–Probe Spectroscopy Simulations
inferred← citeshttps://doi.org/10.1021/acs.jctc.9b01284openalex-snapshot
Field Programmable Gate Arrays for Enhancing the Speed and Energy Efficiency of Quantum Dynamics Simulations
inferred← citeshttps://doi.org/10.1021/acs.jpca.3c03709openalex-snapshot
Pulse-Induced Dynamics of a Charge-Transfer Complex from First Principles
inferred← citeshttps://doi.org/10.1021/acs.jpca.5b12215openalex-snapshot
The Nature of the Donor Motif in Acceptor-Bridge-Donor Dyes as an Influence in the Electron Photo-Injection Mechanism in DSSCs
inferred← citeshttps://doi.org/10.1021/acs.jpcc.1c05230openalex-snapshot
Composition Related Tunability of “Green” Core/Shell Quantum Dots for Photovoltaic Applications from First Principles
inferred← citeshttps://doi.org/10.1021/acs.jpcc.2c02147openalex-snapshot
Plasmon-Induced Hot Carriers: An Atomistic Perspective of the First Tens of Femtoseconds
inferred← citeshttps://doi.org/10.1021/acs.jpcc.3c00809openalex-snapshot
Photoinduced Charge Behavior in a-Si:H/c-Si Heterojunction: Quantum Dynamics Simulation with Vibronic Coupling
inferred← citeshttps://doi.org/10.1021/acs.jpcc.6b05363openalex-snapshot
Disentangling the Photophysics of DNA-Stabilized Silver Nanocluster Emitters
inferred← citeshttps://doi.org/10.1021/acs.jpcc.6b08519openalex-snapshot
Atomistic Insights into Chemical Interface Damping of Surface Plasmon Excitations in Silver Nanoclusters
inferred← citeshttps://doi.org/10.1021/acs.jpcc.6b08910openalex-snapshot
A Non-Thermal Plasma Route to Plasmonic TiN Nanoparticles
inferred← citeshttps://doi.org/10.1021/acs.jpclett.8b01043openalex-snapshot
Trap-Door-Like Irreversible Photoinduced Charge Transfer in a Donor–Acceptor Complex
inferred← citeshttps://doi.org/10.1021/acsami.4c02443openalex-snapshot
Interfacial Charge Transfer in Photoexcited QD-Molecule Composite of Tetrahedral CdSe Quantum Dot Coupled with Carbazole
inferred← citeshttps://doi.org/10.1021/cr3004899openalex-snapshot
Theoretical Insights into Photoinduced Charge Transfer and Catalysis at Oxide Interfaces
inferred← citeshttps://doi.org/10.1021/ja509270fopenalex-snapshot
Photoelectrochemical Hole Injection Revealed in Polyoxotitanate Nanocrystals Functionalized with Organic Adsorbates
inferred← citeshttps://doi.org/10.1021/jp408738bopenalex-snapshot
Efficiency of Interfacial Electron Transfer from Zn-Porphyrin Dyes into TiO2 Correlated to the Linker Single Molecule Conductance
inferred← citeshttps://doi.org/10.1021/jp410638ropenalex-snapshot
Plasmon Enhanced Heterogeneous Electron Transfer: A Model Study
inferred← citeshttps://doi.org/10.1021/jz302099fopenalex-snapshot
Dynamics of Charge-Transfer Processes with Time-Dependent Density Functional Theory
inferred← citeshttps://doi.org/10.1039/c3ra47067aopenalex-snapshot
Role of the main adsorption modes in the interaction of the dye [COOH–TPP-Zn(ii)] on a periodic TiO2 slab exposing a rutile (110) surface in a dye-sentized solar cell
inferred← citeshttps://doi.org/10.1039/c5cp03816bopenalex-snapshot
Density functional investigation and some optical experiments on dye-sensitized quantum dots
inferred← citeshttps://doi.org/10.1039/c6cp00231eopenalex-snapshot
Photoinduced charge-transfer dynamics simulations in noncovalently bonded molecular aggregates
inferred← citeshttps://doi.org/10.1039/c6cp04662bopenalex-snapshot
Effects of the acceptor unit in dyes with acceptor–bridge–donor architecture on the electron photo-injection mechanism and aggregation in DSSCs
inferred← citeshttps://doi.org/10.1039/c6cp08345eopenalex-snapshot
DNA-protected silver emitters: charge dependent switching of fluorescence
inferred← citeshttps://doi.org/10.1039/c7ta03360eopenalex-snapshot
Anionic ancillary ligands in cyclometalated Ru( ii ) complex sensitizers improve photovoltaic efficiency of dye-sensitized solar cells: insights from theoretical investigations
inferred← citeshttps://doi.org/10.1039/c8cp03895copenalex-snapshot
Optical properties and charge distribution in rod-shape DNA–silver cluster emitters
inferred← citeshttps://doi.org/10.1039/c8cp04577aopenalex-snapshot
Quantum dots as an electron or hole acceptor: on some factors affecting charge transfer in dye–quantum dot composites
inferred← citeshttps://doi.org/10.1039/c8cp04625eopenalex-snapshot
Quantum efficiency of the photo-induced electronic transfer in dye–TiO 2 complexes
inferred← citeshttps://doi.org/10.1039/c8tc01466copenalex-snapshot
Effect of quantum tunneling on the efficiency of excitation energy transfer in plasmonic nanoparticle chain waveguides
inferred← citeshttps://doi.org/10.1039/c9pp00118bopenalex-snapshot
Influence of the electron donor properties of hypericin on its sensitizing ability in DSSCs
inferred← citeshttps://doi.org/10.1039/d1nr00213aopenalex-snapshot
Photoinduced charge-transfer in chromophore-labeled gold nanoclusters: quantum evidence of the critical role of ligands and vibronic couplings
inferred← citeshttps://doi.org/10.1039/d1nr04699copenalex-snapshot
Dynamical evolution of the Schottky barrier as a determinant contribution to electron–hole pair stabilization and photocatalysis of plasmon-induced hot carriers
inferred← citeshttps://doi.org/10.1039/d3nr06557jopenalex-snapshot
Rationalization of the light-induced electron injection mechanism in a model 1D ZnO nanowire-dye complex: insights from real-time TD-DFTB simulations
inferred← citeshttps://doi.org/10.1039/d4cp03473bopenalex-snapshot
Engineering highly efficient porphyrin sensitizers through metal, ligand and bridge modification: a DFT study
inferred← citeshttps://doi.org/10.1063/1.4953172openalex-snapshot
Optical properties of graphene nanoflakes: Shape matters
inferred← citeshttps://doi.org/10.1063/1.4973406openalex-snapshot
Monitoring mechanical motion of carbon nanotube based nanomotor by optical absorption spectrum
inferred← citeshttps://doi.org/10.1063/1.5027492openalex-snapshot
Communication: Photoinduced carbon dioxide binding with surface-functionalized silicon quantum dots
inferred← citeshttps://doi.org/10.1063/5.0082960openalex-snapshot
Plasmon-induced excitation energy transfer in silver nanoparticle dimers: A real-time TDDFTB investigation
inferred← citeshttps://doi.org/10.1080/23746149.2019.1710252openalex-snapshot
Density-functional tight-binding: basic concepts and applications to molecules and clusters
inferred← citeshttps://doi.org/10.1088/0953-8984/25/12/125304openalex-snapshot
Quantum dynamical simulations of local field enhancement in metal nanoparticles
inferred← citeshttps://doi.org/10.1088/0953-8984/26/19/195302openalex-snapshot
DSSC anchoring groups: a surface dependent decision
inferred← citeshttps://doi.org/10.1088/0953-8984/27/13/134206openalex-snapshot
Coupled quantum-classical method for long range charge transfer: relevance of the nuclear motion to the quantum electron dynamics
inferred← citeshttps://doi.org/10.1088/0953-8984/27/13/134209openalex-snapshot
Theory of plasmon enhanced interfacial electron transfer
inferred← citeshttps://doi.org/10.26565/2220-637x-2020-34-01openalex-snapshot
Recent advances in theoretical investigation of titanium dioxide nanomaterials. A review
inferred← citeshttps://doi.org/10.3390/ma9100813openalex-snapshot
An Experimental and Theoretical Investigation of the Electronic Structures and Photoelectrical Properties of Ethyl Red and Carminic Acid for DSSC Application
inferred← citeshttps://doi.org/10.3390/molecules200813830openalex-snapshot
Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2
inferred← citeshttps://doi.org/10.3390/nano10050914openalex-snapshot
Theoretical Investigation of Azobenzene-Based Photochromic Dyes for Dye-Sensitized Solar Cells
inferred← citeshttps://doi.org/10.70675/d068c6b1zb419z41f8za880z22d405823bd4openalex-snapshot
Relation Among Localization, Delocalization and Physicochemical Properties. From Electron Density Databases to Magnetic Properties
inferred← citeshttps://doi.org/10.7498/aps.62.237303openalex-snapshot
Plasmon effects on linear spectra related to heterogeneous electron transfer
inferred← citeshttps://doi.org/10.7498/aps.63.137302openalex-snapshot
Study on electron transfer in a heterogeneous system using a density matrix theory approach
Editorial review for independent work. ICSAC — the Institute for Complexity
Science and Advanced Computing — runs a structured editorial panel for researchers
publishing outside journals, and publishes on CiteStamp rails. Submission is free
and goes through ORCID: icsacinstitute.org/submit.