Search Results - "Mahtout, S."
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Structure, Stability, and Electronic and Magnetic Properties of VGen (n = 1-19) Clusters
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11-05-2017)“…We systematically study the equilibrium geometries and electronic and magnetic properties of Gen+1 and VGen (n = 1-19) clusters using the density functional…”
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2
Structure, stability, and electronic properties of niobium-germanium and tantalum-germanium clusters
Published in Journal of molecular modeling (01-05-2019)“…The structural, electronic and magnetic properties of niobium- and tantalum-doped germanium clusters MGe n (M = Nb, Ta and n = 1–19) were investigated by…”
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3
Phosphorus, cobalt‐phosphorus, and nickel‐phosphorus clusters: Growth behavior, electronic, and magnetic properties
Published in International journal of quantum chemistry (05-10-2023)“…The equilibrium geometries, and electronic and magnetic properties of phosphorus, cobalt‐phosphorus, and nickel‐phosphorus (Pn+1, CoPn, and NiPn, n = 1–24)…”
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4
Structure, Stability, and Electronic and Magnetic Properties of VGe n (n = 1–19) Clusters
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (11-05-2017)“…We systematically study the equilibrium geometries and electronic and magnetic properties of Ge n+1 and VGe n (n = 1–19) clusters using the density functional…”
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5
Novel structure and electronic property of Sin (21 ≤n≤30) clusters
Published in Physica. E, Low-dimensional systems & nanostructures (01-08-2008)Get full text
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Structure and electronic property of medium-sized silicon clusters
Published in Physica. E, Low-dimensional systems & nanostructures (2006)“…The lowest energy structures of Si n ( n = 10 – 20 ) clusters are obtained using the first principles pseudopotential simulated annealing within the local…”
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7
Growth Behavior and Electronic Structure of Noble Metal-Doped Germanium Clusters
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (18-01-2018)“…Structures, energetics, and electronic properties of noble metal-doped germanium (MGe n with M = Cu, Ag, Au; n = 1–19) clusters are systematically investigated…”
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8
Investigation of structural, photo and thermoluminescence properties of YAGG:Ce nanogarnet for medical dosimetry application
Published in Radiation physics and chemistry (Oxford, England : 1993) (01-08-2024)“…Cerium-doped yttrium aluminum gallium garnet (YAGG:Ce3+) nanophosphors were synthesized using the sol-gel method. Mixed garnet of Y2.97Al5-xGaxO12:Ce0.03 was…”
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9
Structural, electronic and magnetic properties of Pn+1 and FePn (n=1–14) clusters
Published in Computational and theoretical chemistry (15-12-2017)“…[Display omitted] •Structure of FePn differs from that of Pn+1 clusters.•Fe atom tends to be located at an endohedral position from size n = 7.•Doping with Fe…”
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10
Effect of Iron Atoms on the Properties οf Silicon Cage Clusters
Published in Acta physica Polonica, A (01-10-2013)Get full text
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Structural, electronic and magnetic properties of P n+1 and FeP n (n = 1–14) clusters
Published in Computational and theoretical chemistry (01-12-2017)“…Density functional theory calculations have been performed to study the geometrical structures, relative stabilities, electronic and magnetic properties of P…”
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12
Thermoluminescence properties of β-ray irradiated LuAGG:Ce nanophosphors prepared by sol-gel method for potential applications in dosimetry
Published in Radiation measurements (01-11-2024)“…In this paper, Lu2.97Al5–xGaxO12:Ce0.03 (x = 0, 1, 2, 3) nanophosphors were synthesized using sol-gel method and calcined at 1100 °C for 3 h. The effect of Ga…”
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13
CuCl Nanocrystals in Monocrystalline NaCl Matrix
Published in Physica scripta (01-04-2004)Get full text
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Growth and linear optical properties of CuCl nanocrystals
Published in Semiconductor physics, quantum electronics, and optoelectronics (01-01-2004)“…Linear optical properties of CuCl nanocrystals in a NaCl matrix have been studied using optical absorption, cathodoluminescence and X-ray diffraction…”
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Properties of neutral and charged cobalt-doped arsenic CoAsn(0±1) (n=1–15) clusters by density functional theory
Published in Computational and theoretical chemistry (15-08-2016)“…[Display omitted] •Structure of CoAsn differs from that of Asn+1 clusters.•Structures of charged CoAsn+ and CoAsn− differ from the corresponding neutral…”
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Novel structure and electronic property of Si (21⩽n⩽30) clusters
Published in Physica. E, Low-dimensional systems & nanostructures (01-08-2008)Get full text
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Structural, magnetic and electronic properties of Fe encapsulated by silicon clusters
Published in Physics letters. A (25-12-2006)“…Ab initio calculations based on density functional theory with generalized gradient approximation are performed for Si n Fe ( 9 ⩽ n ⩽ 12 ) clusters to…”
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18
Novel structure and electronic property of Si n (21⩽ n⩽30) clusters
Published in Physica. E, Low-dimensional systems & nanostructures (01-08-2008)“…Using first-principles simulated annealing generalized gradient approximation density functional calculations based on norm-conserving pseudopotentials, we…”
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Optical responses of alkali-halide matrix (NaCl)-doped silver
Published in Physica. E, Low-dimensional systems & nanostructures (01-06-2004)“…In this work, we investigated the optical properties and the evolution of AgCl semiconductor aggregates dispersed in an ionic crystalline matrix, NaCl. These…”
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