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Article
Dicopper(II) Assembly Containing the Tetrameric Cluster of Water Constructed from Terephthalate Dianion and Copper(II) Macrocyclic Fragment
To utilized a mononuclear fragment of [Cu(L)Cl]ClO4 (1) and TPHA bridged-ligand as building block by self-assembly technology, a new dinuclear copper(II) compound [(CuL)2(μ-TPHA)](ClO4)2 · 4H2O (2), where L = 1,3...
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Article
A Six-Connected 3D Europium Coordination Polymer Assembled by 5-Bromoisophthalic Acid (H2BIPA) and 1,10-Phenanthroline (phen): Synthesis, Characterization and Luminescent Property
A novel three-dimensional coordination polymer, [Eu2(phen)2(BIPA)3]·2H2O (1) (BIPA = 5-bromoisophthalate), has been synthsized by the reaction 5-bromoisophthalic acid with Eu(NO3)3·6H2O under the hydrothermal con...
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Article
Fluorene-based oligomers as red light-emitting materials: a density functional theory study
The electronic structures, charge injection and transport, absorption and emission spectra, properties of two series of fluorene-based oligomers {2-[2-{2-[5-(9H-Fluoren-3-yl)-thiophen-2-yl]-vinyl}-6-(2-thiophe...
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Article
Theoretical design study on photophysical property of the B–N derivatives for OLED applications
The photophysical properties of a series of multifunctional compounds applied in organic light-emitting diode (OLED) materials have been studied by quantum chemistry. These compounds have been integrated by an...
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Article
Application of Improved Fuzzy Immune PID Controller to Bending Control System
Based on the hydraulic bending control system, the electrohydraulic servo pressure control simulation model is built. Taking into account of the inadequacy of P-type immune feedback controller, an improved fuz...
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Article
Removal of Phosphorus From High Phosphorus Iron Ores by Selective HCl Leaching Method
The selective HCl leaching method was used to remove phosphorus from high phosphorus iron ores. The hydroxyapatite in high phosphorus iron ores was converted into soluble phosphate during the process of HCl le...
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Article
Theoretical design study on photophysical property of the organoboron quinolate derivatives
The photophysical properties of organoboron quinolate derivatives can be modified readily by manipulating the coordination environment around the central boron atom. This class of compounds applied in organic ...
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Article
Theoretical study on photophysical properties of 2,1,3-benzothiadiazole-based star-shaped molecules
Star-shaped molecules with tailoring functional groups in the core and the arms have great potential application in organic light-emitting devices, because it can be designed to realize low band gap, broad abs...
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Article
A theoretical study on magnesium ion–selective two-photon fluorescent probe based on benzo [h] chromene derivatives
The geometrical structure, electronic structure, and one-photon absorption (OPA) properties of a series of magnesium ion (Mg2+)-selective fluorescent probes based on benzo [h] chromene derivatives have been theor...
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Article
Theoretical investigation of one- and two-photon spectra of pyrazabole chromophores
An extensive series of pyrazabole chromophores containing pseudo-conjugated systems have been theoretically constructed and investigated on the one-photon absorption (OPA) and two-photon absorption (TPA) prope...
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Article
Syntheses, Structures and Luminescent Properties of Zinc(II) and Cadmium(II) Complexes With the Ditopic Ligand 1,3-Bis(imidazol-1-ylmethyl)benzene
Three new complexes, namely [Zn(mbix)(SO4)]·CH3OH (1), Cd(mbix)2(NO3)2 (2) and [Cd(mbix)2(H2O)2]·(NO3)2 (3), have been obtained by reactions of flexible bidentate ligand 1,3-bis(imidazol-1-ylmethyl)benzene (mbix)...
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Article
Application of Improved PSO Algorithm in Hydraulic Pressing System Identification
In view of characteristics of particle swarm optimization (PSO) algorithm of fast convergence but easily falling into local optimum value, a novel improved particle swarm optimization algorithm is put forward,...
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Article
Phylogenetic and structural analysis of major surface proteins hemagglutinin and neuraminidase of novel avian influenza virus A H7N9 from chinese patient
This research reveals the phylogenetic history and structural information of the hemagglutinin(HA) and neuraminidase(NA) from novel avian influenza virus A/Hangzhou/1/2013(H7N9_2013) strain from human infected...
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Article
Construction of post-column micro-membrane reactor for protein analysis in capillary electrophoresis with laser induced fluorescence detection
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Article
Synthesis and characterization of N,N,N′,N′-tetraalkyl-4-oxaheptanediamide as extractant for extraction of uranium(VI) and thorium(IV) ions from nitric acid solution
Tridentate ligand N,N,N′,N′-tetraoctyl-4-oxaheptanediamide(TOOHA) and other three analogous diamides have been prepared and characterized by using NMR spectra and element analysis. The extraction of UO2 ...
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Article
Numerical solution of solvent reorganization energy and its application in electron transfer reaction
According to our recent studies on the nonequilibrium solvation, the solvent reorganization energy λ s is found to be the cost of maintaining the residual polarization, which equilibrates with the...
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Article
Alcohol solvents evaporation-induced self-assembly synthesis of mesoporous TiO2−x−y C x N y nanoparticles toward visible-light driven photocatalytic activity
A one-step solvent evaporation-induced self-assembly (SEISA) process was demonstrated to prepare carbon and nitrogen co-do** mesoporous TiO2 nanoparticles (MesoTiO2−x−y C x ...
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Chapter
Numerical solution of solvent reorganization energy and its application in electron transfer reaction
According to our recent studies on the nonequilibrium solvation, the solvent reorganization energy λ s is found to be the cost of maintaining the residual polarization, which equilibra...
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Article
Modular synthesis of N-glycans and arrays for the hetero-ligand binding analysis of HIV antibodies
A new class of broadly neutralizing antibodies (bNAbs) from HIV donors has been reported to target the glycans on gp120—a glycoprotein found on the surface of the virus envelope—thus renewing hope of developin...
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Article
Li-ion-conductive Li2TiO3-coated Li[Li0.2Mn0.51Ni0.19Co0.1]O2 for high-performance cathode material in lithium-ion battery
Li2TiO3 is used as a novel coating material to modify Li(Li0.2Mn0.51Ni0.19Co0.1)O2 electrode to enhance the electrochemical performance of the host material. After coating, the significant improvements in the ini...