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。First Principles Calculations of Charge Transfer Excitations in Polymer-Fullerene Complexes: Influence of Excess Energy
Dorota Niedzialek et al.
ADVANCED FUNCTIONAL MATERIALS (2015)
Advanced Ellipsometric Characterization of Conjugated Polymer Films
Mariano Campoy-Quiles et al.
ADVANCED FUNCTIONAL MATERIALS (2014)
Spectroscopic Evaluation of Mixing and Crystallinity of Fullerenes in Bulk Heterojunctions
Anne A. Y. Guilbert et al.
ADVANCED FUNCTIONAL MATERIALS (2014)
An Effective Two-Orbital Quantum Chemical Model for Organic Photovoltaic Materials
Guido Raos et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2014)
Influence of Chemical Structure on the Charge Transfer State Spectrum of a Polymer:Fullerene Complex
Sheridan Few et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2014)
Unequal Partnership: Asymmetric Roles of Polymeric Donor and Fullerene Acceptor in Generating Free Charge
Brett M. Savoie et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2014)
Efficient charge generation by relaxed charge-transfer states at organic interfaces
Koen Vandewal et al.
NATURE MATERIALS (2014)
Non-innocent side-chains with dipole moments in organic solar cells improve charge separation
Hilde D. de Gier et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Charge generation mechanism in organic solar cells
Maria Antonietta Loi et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Charge generation in polymer-fullerene bulk-heterojunction solar cells
Feng Gao et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Ultrafast Long-Range Charge Separation in Organic Semiconductor Photovoltaic Diodes
Simon Gelinas et al.
SCIENCE (2014)
On the complex refractive index of polymer:fullerene photovoltaic blends
M. Campoy-Quiles et al.
THIN SOLID FILMS (2014)
Delocalization and dielectric screening of charge transfer states in organic photovoltaic cells
B. Bernardo et al.
NATURE COMMUNICATIONS (2014)
Noise-induced quantum coherence drives photo-carrier generation dynamics at polymeric semiconductor heterojunctions
Eric R. Bittner et al.
NATURE COMMUNICATIONS (2014)
Direct observation of ultrafast long-range charge separation at polymer-fullerene heterojunctions
Francoise Provencher et al.
NATURE COMMUNICATIONS (2014)
Thieno[3,2-b]thiophene-diketopyrrolopyrrole Containing Polymers for Inverted Solar Cells Devices with High Short Circuit Currents
Hugo Bronstein et al.
ADVANCED FUNCTIONAL MATERIALS (2013)
Intermixing at the Pentacene-Fullerene Bilayer Interface: A Molecular Dynamics Study
Yao-Tsung Fu et al.
ADVANCED MATERIALS (2013)
Benchmark theoretical study of the electric polarizabilities of naphthalene, anthracene, and tetracene
M. Huzak et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Comment on Coherence and Uncertainty in Nanostructured Organic Photovoltaics
Shaul Mukamel
JOURNAL OF PHYSICAL CHEMISTRY A (2013)
Electrostatic Effects at Organic Semiconductor Interfaces: A Mechanism for Cold Exciton Breakup
Shane R. Yost et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
Limits on the Fill Factor in Organic Photovoltaics: Distinguishing Nongeminate and Geminate Recombination Mechanisms
George F. A. Dibb et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)
Coherence and Uncertainty in Nanostructured Organic Photovoltaics
Loren G. Kaake et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)
Ultrafast Charge Separation in Organic Photovoltaics Enhanced by Charge Delocalization and Vibronically Hot Exciton Dissociation
Hiroyuki Tamura et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2013)
Hot exciton dissociation in polymer solar cells
G. Grancini et al.
NATURE MATERIALS (2013)
Donor and acceptor levels of organic photovoltaic compounds from first principles
Ismaila Dabo et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2013)
Sub-picosecond delocalization in the excited state of conjugated homopolymers and donor-acceptor copolymers
Natalie Banerji
JOURNAL OF MATERIALS CHEMISTRY C (2013)
Liquid Crystals: Mesomorphic Organization and Thermochromic Luminescence of Dicyanodistyrylbenzene-Based Phasmidic Molecular Disks: Uniaxially Aligned Hexagonal Columnar Liquid Crystals at Room Temperature with Enhanced Fluorescence Emission and Semicondu
Seong-Jun Yoon et al.
ADVANCED FUNCTIONAL MATERIALS (2012)
Mechanism for Efficient Photoinduced Charge Separation at Disordered Organic Heterointerfaces
Harm van Eersel et al.
ADVANCED FUNCTIONAL MATERIALS (2012)
General formula for accurate calculation of halofullerenes polarizability
D. Sh. Sabirov et al.
CHEMICAL PHYSICS LETTERS (2012)
Calculation of longitudinal polarizability and second hyperpolarizability of polyacetylene with the coupled perturbed Hartree-Fock/Kohn-Sham scheme: Where it is shown how finite oligomer chains tend to the infinite periodic polymer
Valentina Lacivita et al.
JOURNAL OF CHEMICAL PHYSICS (2012)
Excited States of Dicyanovinyl-Substituted Oligothiophenes from Many-Body Green's Functions Theory
Bjoern Baumeier et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Frenkel and Charge-Transfer Excitations in Donor-acceptor Complexes from Many-Body Green's Functions Theory
Bjoern Baumeier et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
On the Field Dependence of Free Charge Carrier Generation and Recombination in Blends of PCPDTBT/PC70BM: Influence of Solvent Additives
Steve Albrecht et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2012)
Competition between the Charge Transfer State and the Singlet States of Donor or Acceptor Limiting the Efficiency in Polymer:Fullerene Solar Cells
Mark A. Faist et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
The Effect of Solvent Additives on Morphology and Excited-State Dynamics in PCPDTBT:PCBM Photovoltaic Blends
Fabian Etzold et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Photoexcitation dynamics in polythiophene/fullerene blends for photovoltaic applications
C. -X. Sheng et al.
ORGANIC ELECTRONICS (2012)
Long-range exciton dissociation in organic solar cells
Domenico Caruso et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2012)
Photainduced Carrier Generation and Decay Dynamics in Intercalated and Non-intercalated Polymer: Fullerene Bulk Heterojunctions
William L. Rance et al.
ACS NANO (2011)
Electronic Processes at Organic-Organic Interfaces: Insight from Modeling and Implications for Opto-electronic Devices
David Beljonne et al.
CHEMISTRY OF MATERIALS (2011)
Exciton/Charge-Transfer Electronic Couplings in Organic Semiconductors
Seth Difley et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2011)
A comparative theoretical study of exciton-dissociation and charge-recombination processes in oligothiophene/fullerene and oligothiophene/perylenediimide complexes for organic solar cells
Yuanping Yi et al.
JOURNAL OF MATERIALS CHEMISTRY (2011)
Exciton Dissociation at Thiophene/Fullerene Interfaces: The Electronic Structures and Quantum Dynamics
Hiroyuki Tamura et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2011)
Absolute Rate of Charge Separation and Recombination in a Molecular Model of the P3HT/PCBM Interface
Tao Liu et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2011)
Localization of Electronic Excitations in Conjugated Polymers Studied by DFT
Iffat H. Nayyar et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)
Relating Trends in First-Principles Electronic Structure and Open-Circuit Voltage in Organic Photovoltaics
Eric B. Isaacs et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)
Photogeneration and Recombination in P3HT/PCBM Solar Cells Probed by Time-Delayed Collection Field Experiments
Juliane Kniepert et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)
An Easily Accessible Isoindigo-Based Polymer for High-Performance Polymer Solar Cells
Ergang Wang et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)
Structural variability and dynamics of the P3HT/PCBM interface and its effects on the electronic structure and the charge-transfer rates in solar cells
Tao Liu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Theory of exciton dissociation at the interface between a conjugated polymer and an electron acceptor
A. V. Nenashev et al.
PHYSICAL REVIEW B (2011)
Electronic Properties of Disordered Organic Semiconductors via QM/MM Simulations
Seth Difley et al.
ACCOUNTS OF CHEMICAL RESEARCH (2010)
Charge Photogeneration in Organic Solar Cells
Tracey M. Clarke et al.
CHEMICAL REVIEWS (2010)
On the Interface Dipole at the Pentacene-Fullerene Heterojunction: A Theoretical Study
Mathieu Linares et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2010)
Theoretical Study of the Organic Photovoltaic Electron Acceptor PCBM: Morphology, Electronic Structure, and Charge Localization
David L. Cheung et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2010)
Exciton Formation, Relaxation, and Decay in PCDTBT
Natalie Banerji et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Charge carrier photogeneration and decay dynamics in the poly(2,7-carbazole) copolymer PCDTBT and in bulk heterojunction composites with PC70BM
Minghong Tong et al.
PHYSICAL REVIEW B (2010)
Bimolecular Crystals of Fullerenes in Conjugated Polymers and the Implications of Molecular Mixing for Solar Cells
A. C. Mayer et al.
ADVANCED FUNCTIONAL MATERIALS (2009)
The Energy of Charge-Transfer States in Electron Donor-Acceptor Blends: Insight into the Energy Losses in Organic Solar Cells
Dirk Veldman et al.
ADVANCED FUNCTIONAL MATERIALS (2009)
Electronic Structure and Geminate Pair Energetics at Organic-Organic Interfaces: The Case of Pentacene/C60 Heterojunctions
Stijn Verlaak et al.
ADVANCED FUNCTIONAL MATERIALS (2009)
Is charge transfer transitions really too difficult for standard density functionals or are they just a problem for time-dependent density functional theory based on a linear response approach
Tom Ziegler et al.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2009)
The Effect of Morphology on Electron Field-Effect Mobility in Disordered C60 Thin Films
Joe J. Kwiatkowski et al.
NANO LETTERS (2009)
Bulk heterojunction solar cells with internal quantum efficiency approaching 100%
Sung Heum Park et al.
NATURE PHOTONICS (2009)
Excited states of biological chromophores studied using many-body perturbation theory: Effects of resonant-antiresonant coupling and dynamical screening
Yuchen Ma et al.
PHYSICAL REVIEW B (2009)
Origin of the Efficient Polaron-Pair Dissociation in Polymer-Fullerene Blends
Carsten Deibel et al.
PHYSICAL REVIEW LETTERS (2009)
Coupled cluster calculations for static and dynamic polarizabilities of C60
Karol Kowalski et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Excitation energies in density functional theory: An evaluation and a diagnostic test
Michael J. G. Peach et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Long-range electron and excitation energy transfer in donor-bridge-acceptor systems
Bo Albinsson et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY C-PHOTOCHEMISTRY REVIEWS (2008)
Photoinduced carrier generation in P3HT/PCBM bulk heterojunction materials
In-Wook Hwang et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2008)
Compositional and electric field dependence of the dissociation of charge transfer excitons in alternating polyfluorene copolymer/fullerene blends
Dirk Veldman et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Charge carrier formation in polythiophene/fullerene blend films studied by transient absorption spectroscopy
Hideo Ohkita et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Electronic structures of interfacial states formed at polymeric semiconductor heterojunctions
Ya-Shih Huang et al.
NATURE MATERIALS (2008)
Formation of the interfacial dipole at organic-organic interfaces:: C60/polymer interfaces
Wojciech Osikowicz et al.
ADVANCED MATERIALS (2007)
Energy level alignment between sexithiophene and buckminsterfullerene films
Yan Ge et al.
CHEMICAL PHYSICS LETTERS (2007)
Ultrafast electron transfer and decay dynamics in a small band gap bulk heterojunction material
In-Wook Hwang et al.
ADVANCED MATERIALS (2007)
Charge transfer excitons in bulk heterojunctions of a polyfluorene copolymer and a fullerene derivative
Maria Antonietta Loi et al.
ADVANCED FUNCTIONAL MATERIALS (2007)
Insights on interfacial charge transfer across P3HT/fullerene photovoltaic heterojunction from ab initio calculations
Yosuke Kanai et al.
NANO LETTERS (2007)
Comparison of DFT methods for molecular orbital eigenvalue calculations
Gang Zhang et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
A well-tempered density functional theory of electrons in molecules
Ester Livshits et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
Critical assessment of the performance of density functional methods for several atomic and molecular properties
Kevin E. Riley et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2007)
DRF90: a polarizable force field
M. Swart et al.
MOLECULAR SIMULATION (2006)
Influence of solvent mixing on the morphology and performance of solar cells based on polyfluorene copolymer/fullerene blends
FL Zhang et al.
ADVANCED FUNCTIONAL MATERIALS (2006)
Electronic properties of the organic semiconductor hetero-interface CUPc/C60
OV Molodtsova et al.
APPLIED SURFACE SCIENCE (2005)
Density functional theory with correct long-range asymptotic behavior
R Baer et al.
PHYSICAL REVIEW LETTERS (2005)
Monte-Carlo simulations of geminate electron-hole pair dissociation in a molecular heterojunction: a two-step dissociation mechanism
T Offermans et al.
CHEMICAL PHYSICS (2005)
Molecular control of recombination dynamics in dye-sensitized nanocrystalline TiO2 films:: Free energy vs distance dependence
JN Clifford et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Failure of time-dependent density functional theory for long-range charge-transfer excited states: The zincbacteriochlorin-bacterlochlorin and bacteriochlorophyll-spheroidene complexes
A Dreuw et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2004)
Dipole interactions and electrical polarity in nanosystems: The Clausius-Mossotti and related models
PB Allen
JOURNAL OF CHEMICAL PHYSICS (2004)
A new hybrid exchange-correlation functional using the Coulomb-attenuating method (CAM-B3LYP)
T Yanai et al.
CHEMICAL PHYSICS LETTERS (2004)
Photocurrent generation in polymer-fullerene bulk heterojunctions
VD Mihailetchi et al.
PHYSICAL REVIEW LETTERS (2004)
Separation of geminate charge-pairs at donor-acceptor interfaces in disordered solids
P Peumans et al.
CHEMICAL PHYSICS LETTERS (2004)
Relationship between long-range charge-transfer excitation energy error and integer discontinuity in Kohn-Sham theory
DJ Tozer
JOURNAL OF CHEMICAL PHYSICS (2003)
Electronic polarization in pentacene crystals and thin films
EV Tsiper et al.
PHYSICAL REVIEW B (2003)
Why is exciton dissociation so efficient at the interface between a conjugated polymer and an electron acceptor?
VI Arkhipov et al.
APPLIED PHYSICS LETTERS (2003)
Energy-level alignment at metal-organic and organic-organic interfaces
SC Veenstra et al.
JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS (2003)
Influence of the solvent on the crystal structure of PCBM and the efficiency of MDMO-PPV : PCBM 'plastic' solar cells
MT Rispens et al.
CHEMICAL COMMUNICATIONS (2003)
Ultranonlocality in time-dependent current-density-functional theory: Application to conjugated polymers
M van Faassen et al.
PHYSICAL REVIEW LETTERS (2002)
A long-range correction scheme for generalized-gradient-approximation exchange functionals
H Iikura et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Tracing photoinduced electron transfer process in conjugated polymer/fullerene bulk heterojunctions in real time
CJ Brabec et al.
CHEMICAL PHYSICS LETTERS (2001)
Strongly confined polaron excitations in charged organic semiconductors
M Knupfer et al.
PHYSICAL REVIEW B (2001)
分享论文
