The mechanism of excimer formation: an experimental and theoretical study on the pyrene dimer

Excimer Formation and Symmetry-Breaking Charge Transfer in Cofacial Perylene Dimers

(2017) Rita E. Cook et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Modeling Singlet Fission in Rylene and Diketopyrrolopyrrole Derivatives: The Role of the Charge Transfer State in Superexchange and Excimer Formation

(2017) Claire E. Miller et al.   Journal of Physical Chemistry C

Diabatization for Time-Dependent Density Functional Theory: Exciton Transfers and Related Conical Intersections

(2016) Hiroyuki Tamura   JOURNAL OF PHYSICAL CHEMISTRY A

Singlet Fission via an Excimer-Like Intermediate in 3,6-Bis(thiophen-2-yl)diketopyrrolopyrrole Derivatives

(2016) Catherine M. Mauck et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Permanent excimer superstructures by supramolecular networking of metal quantum clusters

(2016) Beatriz Santiago-Gonzalez et al.   SCIENCE

The ONIOM Method and Its Applications

(2015) Lung Wa Chung et al.   CHEMICAL REVIEWS

Long-range correction for tight-binding TD-DFT

(2015) Alexander Humeniuk et al.   JOURNAL OF CHEMICAL PHYSICS

Evidence for conical intersection dynamics mediating ultrafast singlet exciton fission

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

Real time observation of the excimer formation dynamics of a gas phase benzene dimer by picosecond pump–probe spectroscopy

(2015) Mitsuhiko Miyazaki et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Dynamics of the Excitonic Coupling in Organic Crystals

(2015) Juan Aragó et al.   PHYSICAL REVIEW LETTERS

Intramolecular radiationless transitions dominate exciton relaxation dynamics

(2014) Chanelle C. Jumper et al.   CHEMICAL PHYSICS LETTERS

Dynamical Localization Limiting the Coherent Transport Range of Excitons in Organic Crystals

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

Effect of Local and Global Structural Order on the Performance of Perylene Diimide Excimeric Solar Cells

(2013) Tengling Ye et al.   ACS Applied Materials & Interfaces

Recent Advances in Singlet Fission

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

Singlet Exciton Fission in Polycrystalline Thin Films of a Slip-Stacked Perylenediimide

(2013) Samuel W. Eaton et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Singlet exciton fission in solution

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

The electronic structure of pyracene: a spectroscopic and computational study

(2013) Johannes Auerswald et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Charge-Transfer Excitations Steer the Davydov Splitting and Mediate Singlet Exciton Fission in Pentacene

(2013) D. Beljonne et al.   PHYSICAL REVIEW LETTERS

Two Pyrenylalanines in Dihydrofolate Reductase Form an Excimer Enabling the Study of Protein Dynamics

(2012) Shengxi Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Exciton delocalization and dynamics in helical π-stacks of self-assembled perylene bisimides

(2012) Jong Min Lim et al.   Chemical Science

Ab Initio Studies of Aromatic Excimers Using Multiconfiguration Quasi-Degenerate Perturbation Theory

(2011) Soichi Shirai et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Simulation of laser-induced coupled electron-nuclear dynamics and time-resolved harmonic spectra in complex systems

(2011) Polina G. Lisinetskaya et al.   PHYSICAL REVIEW A

Simulation of time resolved photoelectron spectra with Stieltjes imaging illustrated on ultrafast internal conversion in pyrazine

(2010) Ute Werner et al.   JOURNAL OF CHEMICAL PHYSICS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Zero Kinetic Energy Photoelectron Spectroscopy of Pyrene†

(2010) Jie Zhang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

One-Dimensional Exciton Diffusion in Perylene Bisimide Aggregates

(2010) Henning Marciniak et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Picosecond Dynamics of Dimer Formation in a Pyrene Labeled Polymer

(2010) Telma Costa et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Paracyclophanes as model compounds for strongly interacting π-systems. Part 1. Pseudo-ortho-dihydroxy[2.2]paracyclophane

(2010) Christof Schon et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Excited states of pyrene excimer observed by photodissociation spectroscopy in a supersonic jet

(2009) Yasushi Numata et al.   JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY

Nonadiabatic Dynamics within Time-Dependent Density Functional Tight Binding Method†

(2009) Roland Mitrić et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Deciphering the Influence of Short-Range Electronic Couplings on Optical Properties of Molecular Dimers: Application to “Special Pairs” in Photosynthesis

(2009) Mohamed El-Amine Madjet et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Perylene Tetracarboxydiimide as an Electron Acceptor in Organic Solar Cells: A Study of Charge Generation and Recombination

(2009) Ian A. Howard et al.   Journal of Physical Chemistry C

Nonadiabatic dynamics within the time dependent density functional theory: Ultrafast photodynamics in pyrazine

(2008) Ute Werner et al.   CHEMICAL PHYSICS

Nonadiabatic dynamics and simulation of time resolved photoelectron spectra within time-dependent density functional theory: Ultrafast photoswitching in benzylideneaniline

(2008) Roland Mitrić et al.   JOURNAL OF CHEMICAL PHYSICS

Characterization of the Short-Range Couplings in Excitation Energy Transfer

(2008) Chao-Ping Hsu et al.   Journal of Physical Chemistry C

Time-dependent density functional study of excimers and exciplexes of organic molecules

(2007) Robert Huenerbein et al.   CHEMICAL PHYSICS