Search Results - "Khetrapal, Navneet"
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1
“π-Hole−π” Interaction Promoted Photocatalytic Hydrodefluorination via Inner-Sphere Electron Transfer
Published in Journal of the American Chemical Society (14-12-2016)“…We describe a metal-free, photocatalytic hydrodefluorination (HDF) of polyfluoroarenes (FA) using pyrene-based photocatalysts (Py). The weak “π-hole−π”…”
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2
Structural Evolution of Core-Shell Gold Nanoclusters: Aun- (n = 42-50)
Published in ACS nano (22-11-2016)“…Gold nanoclusters have attracted great attention in the past decade due to their remarkable size-dependent electronic, optical, and catalytic properties…”
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3
Structural Evolution of Gold Clusters Aun- (n = 21-25) Revisited
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (30-03-2017)“…We performed a combined theoretical and experimental photoelectron spectroscopy study of the structural evolution of gold anion clusters Aun- in the size range…”
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4
Large-Sized Aun- Core-Shell Clusters (n = 61-66): Enduring Structure of the Icosahedral Au13 Core
Published in The journal of physical chemistry letters (17-02-2022)Get full text
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5
Large-Sized Au n - Core-Shell Clusters ( n = 61-66): Enduring Structure of the Icosahedral Au 13 Core
Published in The journal of physical chemistry letters (17-02-2022)“…Large-sized gold Au anion clusters exhibit structural characteristics drastically different from other coinage metals. Typically, coinage metal nanoclusters…”
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6
Large-Sized Au n – Core–Shell Clusters (n = 61–66): Enduring Structure of the Icosahedral Au13 Core
Published in The journal of physical chemistry letters (17-02-2022)“…Large-sized gold Au n – anion clusters exhibit structural characteristics drastically different from other coinage metals. Typically, coinage metal…”
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7
Magic-Number Gold Nanoclusters with Diameters from 1 to 3.5 nm: Relative Stability and Catalytic Activity for CO Oxidation
Published in Nano letters (14-01-2015)“…Relative stability of geometric magic-number gold nanoclusters with high point-group symmetry (I h , D 5h , O h ) and size up to 3.5 nm, as well as structures…”
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8
Metal–Metal Bonding in Actinide Dimers: U 2 and U 2
Published in Journal of the American Chemical Society (20-10-2021)Get full text
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9
How O2‑Binding Affects Structural Evolution of Medium Even-Sized Gold Clusters Au n – (n = 20–34)
Published in The journal of physical chemistry letters (15-04-2021)“…We report the first joint anion photoelectron spectroscopy and theoretical study on how O2-binding affects the structures of medium even-sized gold clusters,…”
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10
How O 2 -Binding Affects Structural Evolution of Medium Even-Sized Gold Clusters Au n - ( n = 20-34)
Published in The journal of physical chemistry letters (15-04-2021)“…We report the first joint anion photoelectron spectroscopy and theoretical study on how O -binding affects the structures of medium even-sized gold clusters,…”
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11
How O2-Binding Affects Structural Evolution of Medium Even-Sized Gold Clusters Aun- (n = 20-34)
Published in The journal of physical chemistry letters (15-04-2021)Get full text
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12
Determination of CO Adsorption Sites on Gold Clusters Au n – (n = 21–25): A Size Region That Bridges the Pyramidal and Core–Shell Structures
Published in The journal of physical chemistry letters (20-09-2018)“…We perform a joint photoelectron spectroscopy and theoretical study to investigate CO adsorption sites on midsized gold clusters, Au n – (n = 21–25), a special…”
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13
Influence of 1‑Butene Adsorption on the Dimerization Activity of Single Metal Cations on UiO-66 Nodes
Published in Journal of the American Chemical Society (18-01-2023)“…Grafting metal cations to missing linker defect sites in zirconium-based metal–organic frameworks, such as UiO-66, produces a uniquely well-defined and…”
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14
Metal–Metal Bonding in Actinide Dimers: U2 and U2
Published in Journal of the American Chemical Society (05-10-2021)“…Understanding direct metal-metal bonding between actinide atoms has been an elusive goal in chemistry for years. We report for the first time the anion…”
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15
Metal-organic framework supported single-site nickel catalysts for butene dimerization
Published in Journal of catalysis (01-09-2022)“…[Display omitted] •Experimental and theoretical study of Ni sites at under-coordinated nodes of UiO-66.•Single Ni cations and oxo complexes with few cations…”
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16
Probing the Structural Evolution of Gold–Aluminum Bimetallic Clusters (Au2Al n –, n = 3–11) Using Photoelectron Spectroscopy and Theoretical Calculations
Published in Journal of physical chemistry. C (24-08-2017)“…We report a combined photoelectron spectroscopy and theoretical study of the structural evolution of aluminum cluster anions doped with two gold atoms, Au2Al n…”
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Structural Evolution of Gold-Doped Bismuth Clusters AuBi n – (n = 4–8)
Published in Journal of physical chemistry. C (29-03-2018)“…The structures of gold-doped bismuth clusters, AuBi n – (n = 4–8), are investigated through a joint photoelectron spectroscopy and density functional theory…”
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18
Metal-Metal Bonding in Actinide Dimers: U2 and U2
Published in Journal of the American Chemical Society (20-10-2021)“…Understanding direct metal-metal bonding between actinide atoms has been an elusive goal in chemistry for years. We report for the first time the anion…”
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19
Isomerism and Structural Fluxionality in the Au 26 and Au 26 – Nanoclusters
Published in ACS nano (22-07-2014)Get full text
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20
Structural Evolution of Gold Clusters Au n – (n = 21–25) Revisited
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (30-03-2017)“…We performed a combined theoretical and experimental photoelectron spectroscopy study of the structural evolution of gold anion clusters Au n – in the size…”
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