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Computational studies on optoelectronic and nonlinear optical properties of para-substituted nitrobenzofurazan compound
The activated chlorine atom on 4-chloro-7-nitrobenzofurazan (NBD-chloride, NBD-Cl) by
piperidine, secondary amine, yields a product of the nucleophilic aromatic substitution (SN …
piperidine, secondary amine, yields a product of the nucleophilic aromatic substitution (SN …
DFT-assisted design of curcumin-based donor-π-bridge-acceptor molecular structures: Advancing nonlinear optical materials and sustainable organic solar cells
This study explores the theoretical design of novel curcumin-based structures with
enhanced nonlinear optical (NLO) characteristics. By systematically substituting hydroxyl …
enhanced nonlinear optical (NLO) characteristics. By systematically substituting hydroxyl …
Colorimetric and fluorometric bimodal amine chemosensor based on deprotonation-induced intramolecular charge transfer: Application to food spoilage detection
Amine derivatives are signature organic compounds generated from rotten protein food.
Thus, sensitive detection of the presence of amines in protein foods can be a critical …
Thus, sensitive detection of the presence of amines in protein foods can be a critical …
Photo-physical characteristics of janus green B in different solvents and its interaction mechanism with silver nanoparticles
This work explores the effects of solvent polarity on Janus Green B (JGB) photophysical
properties. The Lippert-Mataga, Billot, and Ravi equations were utilized to calculate the …
properties. The Lippert-Mataga, Billot, and Ravi equations were utilized to calculate the …
Comparative analyses of Nonlinear Optical (NLO) properties, structural characterization and density functional theory of chloro-trifluoromethyl moiety chalcone …
FD Ramzi, QA Wong, NAM Daud, BS Ooi… - Journal of Molecular …, 2024 - Elsevier
This study focuses on the impact of substitutional positions on the nonlinear optical (NLO)
and photophysical properties of four novel chalcone derivatives (I–IV). The grown crystals …
and photophysical properties of four novel chalcone derivatives (I–IV). The grown crystals …
RETRACTED ARTICLE: Optical, photo-physical and photo-stability characterizations of malachite green as a laser dye, combined with TD-DFT simulations
The optical properties of Malachite green (Mg) dye were examined experimentally, including
absorption, optical energy gab, refractive index, dielectric constant, optical conductivity and …
absorption, optical energy gab, refractive index, dielectric constant, optical conductivity and …
An AND-Gate Photoacoustic Probe for Cys and H2S Precise Photoacoustic Sensing in Localized Tumors
Photoacoustic (PA) tomography has shown many promising aspects in noninvasive and
precise imaging of deep-localized biomarkers. However, these traditional single-locked PA …
precise imaging of deep-localized biomarkers. However, these traditional single-locked PA …
Linear and Nonlinear Optical Properties of All-cis and All-trans Poly(p-phenylenevinylene)
Poly (p-phenylenevinylene)(PPV) is a staple of the family of conjugated polymers with
desirable optoelectronic properties for applications including light-emitting diodes (LEDs) …
desirable optoelectronic properties for applications including light-emitting diodes (LEDs) …
A low-molecular-weight, long-wavelength emissive Coumarin: Green synthesis, spectral properties, fluorescence enhancement and solvatochromism application
M You, L Bai, JY Xu, Y Chen, Y Bai - Journal of Molecular Structure, 2024 - Elsevier
In this study, a novel low-molecular-weight coumarin fluorescent dye, 3, 4-dicyano-7-
diethylaminocoumarin, was designed. This dye features a donor-π-bridge-acceptor (D-π-A) …
diethylaminocoumarin, was designed. This dye features a donor-π-bridge-acceptor (D-π-A) …
Intramolecular charge transfer enhanced optical limiting in novel hydrazone derivatives with a D 1–D–A i–π–A structure
H Zhu, D Zhang, X Sun, S Qian, E Feng… - Physical Chemistry …, 2024 - pubs.rsc.org
The present paper investigates one of the hydrazone derivatives (BTH with a D–π–A
structure) based on density functional theory. With the computation results of ground state …
structure) based on density functional theory. With the computation results of ground state …