Results 231 to 240 of about 27,503 (307)

Theoretical insights of silicene doped with transition metals as C - reactive protein biosensors for cardiac vascular applications using density functional theory. [PDF]

RSC Adv
Devi P K, T A, Singh KK, Gaidhane VH, Sood N.   +4 more
europepmc   +1 more source

Ternary Polymer Solar Cells Using Two Nonfullerene Acceptors with Cascading Lumo Level, Smooth Homo Level and Complementary Absorptions

Zhiyong Liu, Han Zhang
openalex   +1 more source

Interface Construction via Scavenging Oxygen Species Enables High‐Performance Li‐Rich Layered Oxide Cathode

Advanced Science, EarlyView.
To inhibit electrolyte decomposition by nucleophilic attack in carbonate electrolyte, LiBOB and LiDFOP with strong oxygen scavenging ability are selected to quench reactive oxygen species and following construct a robust CEI film on the LRLO cathode. The electrochemical performance of the LRLO cathode is largely improved, attributed to decomposition ...
Jiahe Chen, Haoran Ma, Jiajia Huang, Hongbo Wu, Zhen Yang, Chenchen Li, Zhijun Wu, Jingwei Zhao, Min Zhu, Jun Liu   +9 more
wiley   +1 more source

<i>In Silico</i> Perspective on Avobenzone, Octisalate, Octocrylene, Homosalate, and Bemotrizinol as Organic UV Filters Using DFT, TD-DFT, and Molecular Dynamics. [PDF]

ACS Omega
Rigoni ME, de Lazaro SR, de Lara LS.
europepmc   +1 more source

Advances and Perspectives in Graphene‐Based Quantum Dots Enabled Neuromorphic Devices

Advanced Science, EarlyView.
Graphene‐based QDs are zero‐dimensional carbon nanomaterials with pronounced quantum confinement and tunable electronic structures. Herein, we summarize their synthesis strategies and functionalization methods, and highlight their functional roles and operating mechanisms in devices, as well as recent advances in neuromorphic electronics. We anticipate
Yulin Zhen, Wei Zeng, Zherui Zhao, JiYu Zhao, Ziyan Huang, Zhuo Chen, Kui Zhou, Guanglong Ding, Su‐Ting Han, Ye Zhou   +9 more
wiley   +1 more source

Structural evolution and stabilities of (CuIn) _n Te₂ and ((CuIn) _n Te₂)^- (n = 1-8) clusters via DFT study. [PDF]

RSC Adv
Gerezgiher KG, Taklu BW, Berhe TA, Hagos TM, Zeweldi HW.   +4 more
europepmc   +1 more source

Spectroscopic studies (geometry optimization, e → z isomerization, uv/vis, excited states, ft-ir, homo-lumo, fmo, mep, nbo) of new azomethine structures for biological and biochemical applications

, 2019
Anhelina Pazniak, Siyamak Shаhаb, Mohammad Hossein Sheikhi, Liudmila Filippovich   +3 more
openalex   +1 more source

Surface‐Interaction‐Driven Polarity Switching in II–V Cd3P2 Colloidal Quantum Dots for Infrared Photodiodes

Advanced Science, EarlyView.
. ABSTRACT Colloidal quantum dots (CQDs) based on II–V semiconductors offer attractive optical absorption and carrier transport properties for infrared optoelectronics, yet their device‐relevant electronic behavior remains poorly understood. In particular, Cd3P2 CQDs have been constrained by limited control over nanocrystal growth and carrier polarity.
Ha‐Chi V. Tran, Doeun Shim, Youngsang Park, Mahnmin Choi, Hyeonjun Jeong, Guillaume Bonifas, Liyan Ouyang, Celine Nayral, Fabien Delpech, Joongoo Kang, Sohee Jeong   +10 more
wiley   +1 more source

Enhanced Energy Transfer from a Metal–Organic Framework to a Highly Confined Organic Phosphorescent Dye

Advanced Science, EarlyView.
A phosphorescent dye was designed to fit in a hand‐to‐glove fashion into the 1D‐pore channels of MIL‐68(In). We synthesized MIL‐68(In) as powder and thin films, loaded the dye into the pores with controlled packing, and found that the phosphorescence and quantum yield are enhanced.
Bahram Hosseini Monjezi, Thomas Kasper, Gloria Hong, Changfeng Si, Robert Oestreich, Oliver Weingart, Peter G. Weidler, Christof Wöll, Eli Zysman‐Colman, Christoph Janiak, Stefan Bräse, Klaus Müller‐Buschbaum, Alexander Knebel   +12 more
wiley   +1 more source

Theoretical insights into site-specific heavy-atom effects on MR-TADF emitters: modulation of spin-orbit coupling and color purity. [PDF]

Chem Sci
Ge SJ, Wu JR, Jiang ZQ.
europepmc   +1 more source