Vibrational mode contribution to the dielectric permittivity of disordered small-molecule organic semiconductors

Exciton- and Polaron-Induced Reversible Dipole Reorientation in Amorphous Organic Semiconductor Films

(2019) Chao Deng et al.   Advanced Optical Materials

Accurate molecular polarizabilities with coupled cluster theory and machine learning

(2019) David M. Wilkins et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Charge Recombination Dynamics in Organic Photovoltaic Systems with Enhanced Dielectric Constant

(2019) Michael P. Hughes et al.   ADVANCED FUNCTIONAL MATERIALS

Nature of the Lowest Singlet and Triplet Excited States of Organic Thermally Activated Delayed Fluorescence Emitters: A Self-Consistent Quantum Mechanics/Embedded Charge Study

(2019) Zeyi Tu et al.   CHEMISTRY OF MATERIALS

Indication of current-injection lasing from an organic semiconductor

(2019) Atula S. D. Sandanayaka et al.   Applied Physics Express

Method for the Calculation of the Hamaker Constants of Organic Materials by the Lifshitz Macroscopic Approach with Density Functional Theory

(2019) Hideyuki Takagishi et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A window to trap-free charge transport in organic semiconducting thin films

(2019) Naresh B. Kotadiya et al.   NATURE MATERIALS

Quantum mechanical static dipole polarizabilities in the QM7b and AlphaML showcase databases

(2019) Yang Yang et al.   Scientific Data

Built-In Potentials Induced by Molecular Order in Amorphous Organic Thin Films

(2018) Pascal Friederich et al.   ACS Applied Materials & Interfaces

High-performance organic light-emitting diodes comprising ultrastable glass layers

(2018) Joan Ràfols-Ribé et al.   Science Advances

Separating Extreme pH Gradients Using Amphiphilic Copolymer Membranes

(2018) Lorena Ruiz-Pérez et al.   CHEMPHYSCHEM

Resolving and Controlling Photoinduced Ultrafast Solvation in the Solid State

(2017) Milan Delor et al.   Journal of Physical Chemistry Letters

Impact of Dielectric Constant on the Singlet–Triplet Gap in Thermally Activated Delayed Fluorescence Materials

(2017) Haitao Sun et al.   Journal of Physical Chemistry Letters

Software update: the ORCA program system, version 4.0

(2017) Frank Neese   Wiley Interdisciplinary Reviews-Computational Molecular Science

Sky-Blue Phosphorescent OLEDs with 34.1% External Quantum Efficiency Using a Low Refractive Index Electron Transporting Layer

(2016) Hyun Shin et al.   ADVANCED MATERIALS

Ab initio modeling of steady-state and time-dependent charge transport in hole-only α-NPD devices

(2016) Feilong Liu et al.   APPLIED PHYSICS LETTERS

Ellipsometric study and application of rubrene thin film in organic Schottky diode

(2016) Liang Chen et al.   APPLIED SURFACE SCIENCE

Substrate temperature controls molecular orientation in two-component vapor-deposited glasses

(2016) J. Jiang et al.   Soft Matter

Characterization of facial and meridional Alq3 thin films fabricated from physical vapor transport at high substrate temperatures

(2015) Shang-Yu Hung et al.   MATERIALS CHEMISTRY AND PHYSICS

Electroluminescence enhancement in ultraviolet organic light-emitting diode with graded hole-injection and -transporting structure

(2015) Xiaowen Zhang et al.   Physica Status Solidi-Rapid Research Letters

Tunable molecular orientation and elevated thermal stability of vapor-deposited organic semiconductors

(2015) Shakeel S. Dalal et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Simultaneous Manipulation of Intramolecular and Intermolecular Hydrogen Bonds in n-Type Organic Semiconductor Layers: Realization of Horizontal Orientation in OLEDs

(2015) Yuichiro Watanabe et al.   Advanced Optical Materials

Strategy for Enhancing the Dielectric Constant of Organic Semiconductors Without Sacrificing Charge Carrier Mobility and Solubility

(2014) Solmaz Torabi et al.   ADVANCED FUNCTIONAL MATERIALS

Blue organic light-emitting diodes with 2-methyl-9,10-bis(naphthalen-2-yl)anthracene as hole transport and emitting layer and the impedance spectroscopy analysis

(2014) Xiao-Wen Zhang et al.   CURRENT APPLIED PHYSICS

Influence of host matrix on thermally-activated delayed fluorescence: Effects on emission lifetime, photoluminescence quantum yield, and device performance

(2014) Gábor Méhes et al.   ORGANIC ELECTRONICS

Delocalization and dielectric screening of charge transfer states in organic photovoltaic cells

(2014) B. Bernardo et al.   Nature Communications

Influence of the direction of spontaneous orientation polarization on the charge injection properties of organic light-emitting diodes

(2013) Yutaka Noguchi et al.   APPLIED PHYSICS LETTERS

Molecular-scale simulation of electroluminescence in a multilayer white organic light-emitting diode

(2013) Murat Mesta et al.   NATURE MATERIALS

Promising operational stability of high-efficiency organic light-emitting diodes based on thermally activated delayed fluorescence

(2013) Hajime Nakanotani et al.   Scientific Reports

High-efficiency organic light-emitting diodes utilizing thermally activated delayed fluorescence from triazine-based donor–acceptor hybrid molecules

(2012) Sae Youn Lee et al.   APPLIED PHYSICS LETTERS

Charge accumulation at organic semiconductor interfaces due to a permanent dipole moment and its orientational order in bilayer devices

(2012) Yutaka Noguchi et al.   JOURNAL OF APPLIED PHYSICS

Highly efficient organic light-emitting diodes from delayed fluorescence

(2012) Hiroki Uoyama et al.   NATURE

Device efficiency of organic light-emitting diodes: Progress by improved light outcoupling

(2012) Wolfgang Brütting et al.   PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE

A Simple Phosphine-Oxide Host with a Multi-insulating Structure: High Triplet Energy Level for Efficient Blue Electrophosphorescence

(2011) Chunmiao Han et al.   CHEMISTRY-A EUROPEAN JOURNAL

Multiwfn: A multifunctional wavefunction analyzer

(2011) Tian Lu et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Probing structure and phase-transitions in molecular crystals by terahertz time-domain spectroscopy

(2011) Morten Franz et al.   JOURNAL OF MOLECULAR STRUCTURE

Infrared spectroscopy and integrated molar absorptivity of C60 and C70 fullerenes at extreme temperatures

(2011) Susana Iglesias-Groth et al.   MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY

Solution processed high efficiency blue and white phosphorescent organic light-emitting diodes using a high triplet energy exciton blocking layer

(2011) Kyoung Soo Yook et al.   ORGANIC ELECTRONICS

Interfacial charge transfer and charge generation in organic electronic devices

(2011) Toshinori Matsushima et al.   ORGANIC ELECTRONICS

Hole transport in the organic small molecule material α-NPD: evidence for the presence of correlated disorder

(2010) S. L. M. van Mensfoort et al.   JOURNAL OF APPLIED PHYSICS

In situ real-time spectroscopic ellipsometry measurement for the investigation of molecular orientation in organic amorphous multilayer structures

(2010) Daisuke Yokoyama et al.   JOURNAL OF APPLIED PHYSICS

Phenylbenzimidazole-Based New Bipolar Host Materials for Efficient Phosphorescent Organic Light-Emitting Diodes

(2009) Shin-ya Takizawa et al.   CHEMISTRY OF MATERIALS

Calculation of ionization potential of amorphous organic thin-films using solvation model and DFT

(2009) Pabitra K. Nayak et al.   ORGANIC ELECTRONICS

Structural, thermal, and spectral characterization of the different crystalline forms of Alq3, tris(quinolin-8-olato)aluminum(III), an electroluminescent material in OLED technology

(2009) Manju Rajeswaran et al.   POLYHEDRON

Characterization of the electronic excitations in Alq3 using electron energy-loss spectroscopy

(2008) M. Knupfer   APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING

Horizontal molecular orientation in vacuum-deposited organic amorphous films of hole and electron transport materials

(2008) Daisuke Yokoyama et al.   APPLIED PHYSICS LETTERS

All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms

(2008) Dimitrios A. Pantazis et al.   Journal of Chemical Theory and Computation

Static dielectric response of icosahedral fullerenes fromC60toC2160characterized by an all-electron density functional theory

(2008) Rajendra R. Zope et al.   PHYSICAL REVIEW B