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1021
The change in electronic structure of oriented multilayer carbon nanotubes under action of pulsed ion beam of nanosecond duration
Published 2018-07-01“…The formation of new structures is one of the reasons for the increase in the fraction of carbon atoms in sp3-hybridized in the surface layer of MWCNTs.…”
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1022
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1023
Insights into the Intramolecular Properties of η6-Arene-Ru-Based Anticancer Complexes Using Quantum Calculations
Published 2013-01-01“…The intramolecular and intra-atomic properties were computed for two models of these half-sandwich ruthenium anticancer complexes and their respective hydrated forms. …”
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1024
Visible Discrimination of Broadband Infrared Light by Dye-Enhanced Upconversion in Lanthanide-Doped Nanocrystals
Published 2014-01-01“…Until the recent application of broadband absorbing optical antennas, upconversion efficiency in lanthanide-doped nanocrystals was limited by the weak, narrow atomic absorption of a handful of sensitizer elements. …”
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1025
Archimedean unital groups with finite unit intervals
Published 2003-01-01“…Let G be a unital group with a finite unit interval E, let n be the number of atoms in E, and let κ be the number of extreme points of the state space Ω(G). …”
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1026
multiPDEVS: A Parallel Multicomponent System Specification Formalism
Published 2018-01-01“…We next show the soundness of the formalism by giving a construction showing that any multiPDEVS model is equivalent to a PDEVS atomic model. We then present the simulation procedure associated, usually called abstract simulator. …”
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1027
Thermodynamic measurements and ab initio calculations of the indium-lithium system
Published 2023-01-01“…A further investigation on the atomic arrangement in the case of the equiatomic ratio is suggested.…”
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1028
Photo-Irradiated Biosynthesis of Silver Nanoparticles Using Edible Mushroom Pleurotus florida and Their Antibacterial Activity Studies
Published 2011-01-01“…The appearance, size, and shape of the silver nanoparticles are understood by UV-visible spectroscopy, field emission scanning electron microscopy, transmission electron microscopy, and atomic force microscopy. The X-ray diffraction studies, energy dispersive X-ray analysis indicate that particles are crystalline in nature. …”
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1029
Growth and Switching of Ferroelectric Nanocrystals from Ultrathin Film of Copolymer of Vinylidene Fluoride and Trifluoroethylene
Published 2011-01-01“…The nanocrystals presumably belong to orthorhombic space group, where axis 2 is the direction of spontaneous polarization (and normal to substrate). By means of atomic force microscopy (AFM), the kinetics of ferroelectric nanocrystals growth and their switching were investigated. …”
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1030
An Investigation into the Evolution Law of Young’s Modulus of Polyurethane Coatings with Diluent Contents by Microstructure-Based Tests
Published 2022-01-01“…Force-displacement curves and microscan images of the coatings were obtained by atomic force microscopy, and the Young’s modulus of the coatings was calculated on the basis of the indentation method, and positron annihilation lifetime spectroscopy was used to test the microstructure of the coatings. …”
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1031
The Boundedness of Some Integral Operators on Weighted Hardy Spaces Associated with Schrödinger Operators
Published 2015-01-01“…In this paper, we will first define molecules for weighted Hardy spaces HLp(w) (0<p≤1) associated with L and establish their molecular characterizations. Then, by using the atomic decomposition and molecular characterization of HLp(w), we will show that the imaginary power Liγ is bounded on HLp(w) for n/(n+1)<p≤1, and the fractional integral operator L-α/2 is bounded from HLp(w) to HLq(wq/p), where 0<α<min{n/2,1}, n/(n+1)<p≤n/(n+α), and 1/q=1/p-α/n.…”
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1032
Determination of nuclear charge radius by extreme-ultraviolet spectroscopy of Na-like ions
Published 2025-02-01“…We report on a method for determining the absolute nuclear charge radius of high-Z elements using extreme-ultraviolet spectroscopy of highly charged Na-like ions in tandem with highly accurate atomic structure calculations of transition energy differences. …”
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1033
Temperature-Dependent Generalized Planar Fault Energy and Twinnability of Mg Microalloyed with Er, Ho, Dy, Tb, and Gd: First-Principles Study
Published 2016-01-01“…It is interesting to note that alloying larger atomic radius will enhance the ductility of Mg more easily and alloying smaller radius will make twinning tendency of Mg more easily. …”
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1034
Application of Statistical Experimental Design and Surface Plot Technique to Optimize Oxygenated Apatite Synthesis
Published 2020-01-01“…An experimental design is applied to precise the influence of the synthesis parameters (pH of the reaction medium, atomic ratio Ca/P of the reagents, concentration of the calcium solution (Ca2+), temperature of the reaction medium (T), and duration of the reaction (D)) on the chemical composition (Ca/P molar ratio, % O2, and % O22−). …”
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1035
Protocols for translocation processes of flexible polymers through a pore using LAMMPS
Published 2025-03-01“…Summary: Large-scale Atomic/Molecular Massively Parallel Simulator (LAMMPS) is an open-source, powerful simulator with a customizable platform for extensive Langevin dynamics simulations. …”
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1036
Synthesis and Antioxidant Activities of Novel 5-Chlorocurcumin, Complemented by Semiempirical Calculations
Published 2013-01-01“…Molecular orbital calculations provided a detailed description of the orbitals, including spatial characteristics, nodal patterns, and the contributions of individual atoms.…”
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1037
Electrochemical Solvent Cointercalation into Graphite in Propylene Carbonate-Based Electrolytes: A Chronopotentiometric Characterization
Published 2018-01-01“…Herein, the redox reactions of solvated lithium ions occurring at the graphite interface in 1 M·LiClO4/PC were probed by chronopotentiometry, in situ atomic force microscopy (AFM), and in situ Raman spectroscopy. …”
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1038
RECONSTRUCTION OF DIVACANCY IN ZIGZAG-BUCKLED SILICENE NANORIBBONS
Published 2024-03-01“…The results show that the first- and second-order interaction parameters of two atoms of the same type play an important role in the electronic properties of this material. …”
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1039
Can We Observe the Gravitational Quantum States of Positronium?
Published 2015-01-01“…Collimation and Stark deceleration of Rydberg positronium atoms allow selecting the required velocity class. …”
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1040
Methods for Predicting Speed of Sound in Fatty Acid Ethyl Esters and Ethylic Biodiesels Using Gibbs Energy Additivity
Published 2024-01-01“…This study presents Gibbs energy additivity methods for predicting the speed of sound in saturated or unsaturated fatty acids, ethyl ester, or an ethylic biodiesel based on either (1) the number of carbon atoms (z) and number of double bonds (nd) of the fatty acid or (2) the saponification number (SN) and iodine value (IV) of the fatty acid. …”
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