Rational design of doubly-bridged chromophores for singlet fission and triplet–triplet annihilation

Vibronic exciton theory of singlet fission. I. Linear absorption and the anatomy of the correlated triplet pair state

(2017) Roel Tempelaar et al.   JOURNAL OF CHEMICAL PHYSICS

Singlet fission in pancake-bonded systems

(2017) S. Ito et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

High-Yield Excited Triplet States in Pentacene Self-Assembled Monolayers on Gold Nanoparticles through Singlet Exciton Fission

(2016) Daiki Kato et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Design Principles of Electronic Couplings for Intramolecular Singlet Fission in Covalently-Linked Systems

(2016) Soichi Ito et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Solution-Phase Singlet Fission in a Structurally Well-Defined Norbornyl-Bridged Tetracene Dimer

(2016) Jasper D. Cook et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Intramolecular Triplet–Triplet Annihilation Upconversion in 9,10-Diphenylanthracene Oligomers and Dendrimers

(2016) Damir Dzebo et al.   Journal of Physical Chemistry C

Quantum Master Equation Approach to Singlet Fission Dynamics of Realistic/Artificial Pentacene Dimer Models: Relative Relaxation Factor Analysis

(2016) Masayoshi Nakano et al.   Journal of Physical Chemistry C

Intra- and Intermolecular Singlet Fission in Covalently Linked Dimers

(2016) Xintian Feng et al.   Journal of Physical Chemistry C

Fluctuations in Electronic Energy Affecting Singlet Fission Dynamics and Mixing with Charge-Transfer State: Quantum Dynamics Study

(2016) Yuta Fujihashi et al.   Journal of Physical Chemistry Letters

Diradical Character-Based Design for Singlet Fission of Bisanthene Derivatives: Aromatic-Ring Attachment and π-Plane Twisting

(2016) Soichi Ito et al.   Journal of Physical Chemistry Letters

Through-Linker Intramolecular Singlet Fission: General Mechanism and Designing Small Chromophores

(2016) Tao Zeng   Journal of Physical Chemistry Letters

Design of Small Intramolecular Singlet Fission Chromophores: An Azaborine Candidate and General Small Size Effects

(2016) Tao Zeng et al.   Journal of Physical Chemistry Letters

Exciton Correlations in Intramolecular Singlet Fission

(2016) Samuel N. Sanders et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Near-Infrared-to-Visible Photon Upconversion Sensitized by a Metal Complex with Spin-Forbidden yet Strong S0–T1 Absorption

(2016) Shogo Amemori et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Singlet Fission in a Covalently Linked Cofacial Alkynyltetracene Dimer

(2016) Nadezhda V. Korovina et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Solution-based intramolecular singlet fission in cross-conjugated pentacene dimers

(2016) Johannes Zirzlmeier et al.   Nanoscale

A Direct Mechanism of Ultrafast Intramolecular Singlet Fission in Pentacene Dimers

(2016) Eric G. Fuemmeler et al.   ACS Central Science

Basic concepts of quantum interference and electron transport in single-molecule electronics

(2015) C. J. Lambert   CHEMICAL SOCIETY REVIEWS

Interference between Coulombic and CT-mediated couplings in molecular aggregates: H- to J-aggregate transformation in perylene-based π-stacks

(2015) Nicholas J. Hestand et al.   JOURNAL OF CHEMICAL PHYSICS

Unveiling Singlet Fission Mediating States in TIPS-pentacene and its Aza Derivatives

(2015) Julia Herz et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Theory of Singlet Fission in Polyenes, Acene Crystals, and Covalently Linked Acene Dimers

(2015) Karan Aryanpour et al.   Journal of Physical Chemistry C

Intermolecular Vibrational Modes Speed Up Singlet Fission in Perylenediimide Crystals

(2015) Nicolas Renaud et al.   Journal of Physical Chemistry Letters

Density Analysis of Intra- and Intermolecular Vibronic Couplings toward Bath Engineering for Singlet Fission

(2015) Soichi Ito et al.   Journal of Physical Chemistry Letters

How Morphology Affects Singlet Fission in Crystalline Tetracene

(2015) Geoffrey B. Piland et al.   Journal of Physical Chemistry Letters

Photon Upconversion in Supramolecular Gel Matrixes: Spontaneous Accumulation of Light-Harvesting Donor–Acceptor Arrays in Nanofibers and Acquired Air Stability

(2015) Pengfei Duan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Quantitative Intramolecular Singlet Fission in Bipentacenes

(2015) Samuel N. Sanders et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Real-time observation of multiexcitonic states in ultrafast singlet fission using coherent 2D electronic spectroscopy

(2015) Artem A. Bakulin et al.   Nature Chemistry

Evidence for conical intersection dynamics mediating ultrafast singlet exciton fission

(2015) Andrew J. Musser et al.   Nature Physics

Temperature-dependent singlet exciton fission observed in amorphous rubrene films

(2015) Jing Li et al.   ORGANIC ELECTRONICS

Molecular design of electron transport with orbital rule: toward conductance-decay free molecular junctions

(2015) Tomofumi Tada et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

DFT-based Green's function pathways model for prediction of bridge-mediated electronic coupling

(2015) Laura Berstis et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

First-Principles Quantum Dynamics of Singlet Fission: Coherent versus Thermally Activated Mechanisms Governed by MolecularπStacking

(2015) Hiroyuki Tamura et al.   PHYSICAL REVIEW LETTERS

Singlet fission in pentacene dimers

(2015) Johannes Zirzlmeier et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Upconversion Luminescent Materials: Advances and Applications

(2014) Jing Zhou et al.   CHEMICAL REVIEWS

Microscopic theory of singlet exciton fission. III. Crystalline pentacene

(2014) Timothy C. Berkelbach et al.   JOURNAL OF CHEMICAL PHYSICS

Quasi-diabatic States from Active Space Decomposition

(2014) Shane M. Parker et al.   Journal of Chemical Theory and Computation

Exploring Non-Condon Effects in a Covalent Tetracene Dimer: How Important Are Vibrations in Determining the Electronic Coupling for Singlet Fission?

(2014) Ethan C. Alguire et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Model Hamiltonian Analysis of Singlet Fission from First Principles

(2014) Shane M. Parker et al.   Journal of Physical Chemistry C

Theoretical Molecular Design of Heteroacenes for Singlet Fission: Tuning the Diradical Character by Modifying π-Conjugation Length and Aromaticity

(2014) Soichi Ito et al.   Journal of Physical Chemistry C

Maximizing Singlet Fission by Intermolecular Packing

(2014) Linjun Wang et al.   Journal of Physical Chemistry Letters

Seeking Small Molecules for Singlet Fission: A Heteroatom Substitution Strategy

(2014) Tao Zeng et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Multiphonon Relaxation Slows Singlet Fission in Crystalline Hexacene

(2014) Erik Busby et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A transferable model for singlet-fission kinetics

(2014) Shane R. Yost et al.   Nature Chemistry

A Correlated Electron View of Singlet Fission

(2013) Paul M. Zimmerman et al.   ACCOUNTS OF CHEMICAL RESEARCH

Recent Advances in Singlet Fission

(2013) Millicent B. Smith et al.   Annual Review of Physical Chemistry

Microscopic theory of singlet exciton fission. II. Application to pentacene dimers and the role of superexchange

(2013) Timothy C. Berkelbach et al.   JOURNAL OF CHEMICAL PHYSICS

Electronic Structure Study of Singlet Fission in Tetracene Derivatives

(2013) David Casanova   Journal of Chemical Theory and Computation

Hexadecadehydrodibenzo[20]-, Tetracosadehydrotribenzo[30]-, and Dotriacontadehydrotetrabenzo[40]annulenes: Syntheses, Characterizations, Electronic Properties, and Self-Associations

(2013) Shin-ichiro Kato et al.   JOURNAL OF ORGANIC CHEMISTRY

Tunable Electronic Coupling and Driving Force in Structurally Well-Defined Tetracene Dimers for Molecular Singlet Fission: A Computational Exploration Using Density Functional Theory

(2013) Paul J. Vallett et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Toward Designed Singlet Fission: Solution Photophysics of Two Indirectly Coupled Covalent Dimers of 1,3-Diphenylisobenzofuran

(2013) Justin C. Johnson et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Fundamental of Diradical-Character-Based Molecular Design for Singlet Fission

(2013) Takuya Minami et al.   Journal of Physical Chemistry Letters

Fission of Entangled Spins: An Electronic Structure Perspective

(2013) Xintian Feng et al.   Journal of Physical Chemistry Letters

Temperature-Independent Singlet Exciton Fission in Tetracene

(2013) Mark W. B. Wilson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Singlet exciton fission in solution

(2013) Brian J. Walker et al.   Nature Chemistry

Designing J- and H-Aggregates through Wave Function Overlap Engineering: Applications to Poly(3-hexylthiophene)

(2012) Hajime Yamagata et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Diradical Character Based Design for Singlet Fission of Condensed-Ring Systems with 4nπ Electrons

(2012) Soichi Ito et al.   Journal of Physical Chemistry C

Magnetic Field Effects on Singlet Fission and Fluorescence Decay Dynamics in Amorphous Rubrene

(2012) Geoffrey B. Piland et al.   Journal of Physical Chemistry C

Theoretical Study of Singlet Fission in Oligorylenes

(2012) Takuya Minami et al.   Journal of Physical Chemistry Letters

Efficient Singlet Fission Discovered in a Disordered Acene Film

(2012) Sean T. Roberts et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Search for a Small Chromophore with Efficient Singlet Fission: Biradicaloid Heterocycles

(2012) Akin Akdag et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The energy barrier in singlet fission can be overcome through coherent coupling and entropic gain

(2012) Wai-Lun Chan et al.   Nature Chemistry

The nature of singlet excitons in oligoacene molecular crystals

(2011) H. Yamagata et al.   JOURNAL OF CHEMICAL PHYSICS

Electronic, Spectroscopic, and Ion-Sensing Properties of a Dehydro[m]pyrido[14]- and [15]annulene Isomer Library

(2011) Paul N. W. Baxter et al.   JOURNAL OF ORGANIC CHEMISTRY

Diradical Character View of Singlet Fission

(2011) Takuya Minami et al.   Journal of Physical Chemistry Letters

Mechanism for Singlet Fission in Pentacene and Tetracene: From Single Exciton to Two Triplets

(2011) Paul M. Zimmerman et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ultrafast Dynamics of Exciton Fission in Polycrystalline Pentacene

(2011) Mark W. B. Wilson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Singlet Fission

(2010) Millicent B. Smith et al.   CHEMICAL REVIEWS

Photon upconversion based on sensitized triplet–triplet annihilation

(2010) Tanya N. Singh-Rachford et al.   COORDINATION CHEMISTRY REVIEWS

Characterizing the Locality of Diabatic States for Electronic Excitation Transfer By Decomposing the Diabatic Coupling

(2010) Josh Vura-Weis et al.   Journal of Physical Chemistry C

The Spectral Signatures of Frenkel Polarons in H- and J-Aggregates

(2009) Frank C. Spano   ACCOUNTS OF CHEMICAL RESEARCH

Synthesis of extended polyynes: Toward carbyne

(2008) Wesley A. Chalifoux et al.   COMPTES RENDUS CHIMIE