Results 271 to 280 of about 2,372,774 (365)

Studies in molecular dynamics: new criteria for evaluation of intramolecular force fields

, 1977
Nair S Sasidharan, K Babu Joseph
openalex   +1 more source

High‐Efficiency TADF Dendritic Emitters Enabled by Synchronously Inhibiting Degenerated Triplet Excited States and Structural Relaxation Toward Solution‐Processed OLEDs with EQE Over 33%

Advanced Science, EarlyView.
Asymmetrical thermally activated delated fluorescence dendritic emitters are delicately constructed through symmetry breaking strategy, and near‐unity photoluminescence efficiency and excellent reverse intersystem crossing process are achieved via breaking the degeneracy of vibrational levels and boosting the spin flip of triplet excitons.
Xiaoxiang Yu, Wei Ping, Chengshuang Song, Jinyang Zhao, Lei Hua, Junjie Wang, Shian Ying, Yuchao Liu, Zhongjie Ren, Shouke Yan   +9 more
wiley   +1 more source

Using Dopants as Agents to Probe Key Electronic Properties of Organic Semiconductors

Advanced Electronic Materials, EarlyView.
Dopants are typically used in organic electronics to enhance conductivity, but here their potential is demonstrated as probes for fundamental material properties. By integrating experimental data and multiscale simulations, it is shown how dopant ionization and conductivity measurements enable accurate extraction of ionization potential and Coulomb ...
Artem Fediai, Franz Symalla, Tobias Neumann, Wolfgang Wenzel   +3 more
wiley   +1 more source

Systematic C-C Bond Cleavage in Oligomers via Diels-Alder Reaction on Au(111). [PDF]

ACS Nano
Li D, Ohto T, Nishiuchi T, Takeuchi S, Nishide Y, Kimizuka H, Kubo T, Kawai S.   +7 more
europepmc   +1 more source

Beyond Silicon: Toward Sustainable, NIR‐II, and Conformable Organic Photodiodes

Advanced Energy Materials, EarlyView.
In this perspective, a strategic shift in organic photodetector (OPD) research is proposed: instead of the incremental advances in silicon's stronghold arena, the most impactful future for OPDs lies in addressing silicon's intrinsic limitations, i.e., detection in the longer wavelength range above silicon's coverage (>1100 nm, termed as near infrared ...
Hrisheekesh Thachoth Chandran, Jiaming Huang, Hao Xia, Rakesh Rajendran Nair, Shen Xing, Gang Li, Karl Leo, Johannes Benduhn   +7 more
wiley   +1 more source

Charge Regulation Enables Uptake of Ampholytes to Polyelectrolyte Brushes. [PDF]

ACS Macro Lett
Staňo R, Košovan P.
europepmc   +1 more source

Modulation of intramolecular Fe oxidation with distance and driving force in Ru–Fe photocatalysts

Christian Herrero, Frédéric Banse, Winfried Leibl, Annamaria Quaranta   +3 more
openalex   +2 more sources

Toward a Rational Design of Conjugated Copolymers with Oxygenated Side Chains for Boosting Thermoelectric Properties

Advanced Energy Materials, EarlyView.
The molecular design strategy that integrates both side chain and backbone engineering in diketopyrrolopyrrole‐based conjugated polymers to identify the optimal balance between doping efficiency and microstructural order is demonstrated. Comprehensive spectroscopic, electrochemical, morphological, and structural characterizations reveal that the ...
Taewoong Han, Suhui Sim, Hoimin Kim, Taewoong Yoon, Hyungju Ahn, Seungjoo Chang, Namgyu Park, Hajeong Kim, Shabaz Alam, Dongki Lee, Sungjun Park, Sungjoo Lee, Jaewon Lee, Boseok Kang   +13 more
wiley   +1 more source

A global survey of intramolecular isopeptide bonds. [PDF]

Protein Sci
Costa F, Riziotis I, Andreeva A, Kalwan D, de Jong J, Hinchliffe P, Parmeggiani F, Race PR, Burston SG, Bateman A, Barringer R.   +10 more
europepmc   +1 more source

Enhancing Automation and Interpretability of Vibrational Spectra Predictions for Water Clusters from Diffusion Monte Carlo. [PDF]

J Phys Chem A
Zhu S, Madison LR.
europepmc   +1 more source