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921
Calculation of parameters of elementary nanocrystals of liquid metals at melting temperature
Published 2021-12-01“…It has been shown that radii of elementary nanocrystals are from 2 nm to 12 nm, and the number of atoms in each elementary nanocrystal varies from 2000 to 100000. …”
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922
L1 spaces fail a certain aapproximative property
Published 1998-01-01“…He shows that if X=ℓ1 or L1(μ) for some non-purely atomic measure μ, then X does not have the property P1. …”
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923
Arcjet plasma temperature estimation in thruster device
Published 2018-10-01“…It greatly means the compression process in adiabatic character and gas temperature increasing for excited atoms Boltzmann distribution over the energy levels. …”
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924
Optical Emission of the Nuclear-Induced Plasmas of Gas Mixtures
Published 2014-01-01“…Results obtained from research of active laser media concerning the p-s transitions of atoms of neon, mercury, and cadmium are presented. …”
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925
Maximal and Area Integral Characterizations of Bergman Spaces in the Unit Ball of ℂn
Published 2013-01-01“…Moreover, we give an atomic decomposition of real-variable type with respect to Carleson tubes for Bergman spaces.…”
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926
Synthesis of Heterogeneous Copper Catalyst Based on Amino-Functionalized Triazine Rings Supported by Silica-Gel for Oxidation of Alcohols
Published 2013-01-01“…The copper (II) content of the material was determined by atomic absorption. This novel transition metal supported on heterogeneous surface was used as an effective catalyst for oxidation of benzylic alcohols in the presence of H2O2. …”
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927
Highly Sensitive Colorimetric Assay for Determining Fe3+ Based on Gold Nanoparticles Conjugated with Glycol Chitosan
Published 2017-01-01“…The Fe3+ ion coordinates with the oxygen atoms of GC in a hexadentate manner (O-Fe3+-O), decreasing the interparticle distance and inducing aggregation. …”
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928
Photocatalytic asymmetric C-C coupling for CO2 reduction on dynamically reconstructed Ruδ+-O/Ru0-O sites
Published 2025-01-01“…This work provides an insightful understanding of active sites with dynamic reconstruction towards asymmetric C-C coupling for CO2RR at the atomic scale.…”
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929
Aurophilic interaction-based aggregation of gem-digold(I) aryls towards high spin-orbit coupling and strong phosphorescence
Published 2025-01-01“…Abstract Luminescent gold(I) compounds have attracted intensive attention due to anticipated strong spin-orbit coupling (SOC) resulting from heavy atom effect of gold atoms. However, some mononuclear gold(I) compounds are barely satisfactory. …”
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930
SOLEDGE3X full vessel plasma boundary simulations of ITER non-active phase plasmas
Published 2025-01-01“…The erosion contributions from neutrals and ions are considered in each case, and the charge-exchange atoms fluxes and energy distributions are provided, highlighting the two atom populations (cold and charge-exchange).…”
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931
Leveraging multiplexed metasurfaces for multi-task learning with all-optical diffractive processors
Published 2024-10-01“…We further introduce a novel end-to-end joint optimization framework to redesign the three-task classifier, demonstrating substantial improvements over the meta-atom library design and offering the potential for future multi-channel DNN designs. …”
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932
Highly Tunable Moiré Superlattice Potentials in Twisted Hexagonal Boron Nitrides
Published 2025-01-01“…Abstract Moiré superlattice of twisted hexagonal boron nitride (hBN) has emerged as an advanced atomically thin van der Waals interfacial ferroelectricity platform. …”
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933
Sb2S3-templated synthesis of sulfur-doped Sb-N-C with hierarchical architecture and high metal loading for H2O2 electrosynthesis
Published 2023-01-01“…Main-group metal and nitrogen coordinated carbons (M-N-Cs) are promising but remain largely underexplored due to the low metal-atom density and the lack of understanding in the structure-property correlation. …”
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934
fragSMILES as a chemical string notation for advanced fragment and chirality representation
Published 2025-01-01“…However, such ‘atom-level’ string representations could have certain limitations, in terms of capturing information on chirality, and synthetic accessibility of the corresponding designs. …”
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935
Electrochemically synthesized H2O2 at industrial-level current densities enabled by in situ fabricated few-layer boron nanosheets
Published 2024-12-01“…Theoretical simulations and experimental studies demonstrate that the superior catalytic performance originates from B atoms with adsorbed O atoms in the boron nanosheets. …”
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936
Mineral Composition of Four Edible Mushrooms
Published 2013-01-01“…Two cultivated mushroom species, namely, Lentinula edodes and Pleurotus florida and two wild growing species Lentinus cladopus and Pleurotus djamor were studied for their mineral contents such as Ca, Mg, Na, K, Fe, Zn, Mn, Cu, Ni, Se, Pb, and Cd by Inductive Coupled Plasma Atomic Emission Spectroscopy (ICP-AES) and also Atomic Absorption Spectroscopy, (AAS). …”
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937
A novel method for calculating number buildup factor in gamma-ray transmission measurements using narrow beam geometry
Published 2024-01-01“…Furthermore, the slope of these linear relationships can be expressed as a product of mass density and a cubic polynomial function of the atomic number. Based on these findings, we developed a fitting formula to calculate the number buildup factor using the input variables of sample thickness, mass density, and atomic number. …”
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938
Self‐supported thin‐film electrode consisting of transition metal borides for highly efficient hydrogen evolution
Published 2025-01-01“…Theoretical study reveals that both surfaces terminated by TM and B atoms can serve as the active sites and the H* binding strength of TMBs is correlated with the p band center of B atoms. …”
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939
Quantum Chemical Topological Analysis of [2Fe2S] Core in Novel [FeFe]-Hydrogenase Mimics
Published 2025-01-01“…Next, one of the first applications of the interacting quantum atoms (IQA) method to [FeFe]-hydrogenase mimics was presented. …”
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940
Bluues_cplx: Electrostatics at Protein–Protein and Protein–Ligand Interfaces
Published 2025-01-01“…Electrostatic complementarity at the interface is not trivial, involving surface potentials rather than the charges of surfacial contacting atoms. (2) Results: The program bluues_cplx, here used in conjunction with the software NanoShaper to compute molecular surfaces, has been used to compute the electrostatic properties of 756 protein–protein and 189 protein–ligand complexes along with the corresponding isolated molecules. (3) Methods: The software we make available here uses Generalized Born (GB) radii, computed by a molecular surface integral, to output several descriptors of electrostatics at protein (and in general, molecular) interfaces. …”
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