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Reactions of Laser Ablated Titanium, Zirconium, and Hafnium Atoms with Oxygen Molecules in Condensing Argon

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An Improved Self-Consistent-Charge Density-Functional Tight-Binding (SCC-DFTB) Set of Parameters for Simulation of Bulk and Molecular Systems Involving Titanium
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Preparation of CH3TiF and (CH3)2TiF2 from the Reaction of CH3F with Laser-Ablated Ti Atoms
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Reactions of Methane with Titanium Atoms: CH3TiH, CH2TiH2, Agostic Bonding, and (CH3)2TiH2
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Infrared Spectrum and Structure of the Hf(OH)4 Molecule
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Group 4 Transition Metal CH2MF2, CHFMF2, and HC÷MF3 Complexes Formed by C−F Activation and α-Fluorine Transfer
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Laser Desorption/Ionization of Transition Metal Atoms and Oxides from Solid Argon
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Reactions of Laser-Ablated Ag and Au Atoms with Carbon Monoxide: Matrix Infrared Spectra and Density Functional Calculations on Ag(CO)n (n = 2, 3), Au(CO)n (n = 1, 2) and M(CO)n+ (n = 1−4; M = Ag, Au)
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Systematic Study of Oxo, Peroxo, and Superoxo Isomers of 3d-Metal Dioxides and Their Anions
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Photoreversible Hydrogen Migration System in a Solid Argon Matrix Formed by the Reaction of Methyl Fluoride with Laser-Ablated Titanium Atoms
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Group 4 Transition Metal−Benzene Adducts: Carbon Ring Deformation upon Complexation
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Matrix Isolation Spectroscopic and Theoretical Study of Carbon Dioxide Activation by Titanium Oxide Molecules
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Monohafnium Oxide Clusters HfOn–and HfOn(n= 1–6): Oxygen Radicals, Superoxides, Peroxides, Diradicals, and Triradicals
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Molecular Structures and Energetics of the (TiO 2 ) n ( n = 1−4) Clusters and Their Anions
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Infrared Spectra and Density Functional Theory Calculations of Group 8 Transition Metal Sulfide Molecules
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Molecular Structures and Energetics of the (ZrO2)n and (HfO2)n (n = 1−4) Clusters and Their Anions
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Reactions of Laser-Ablated Iron Atoms with Oxygen Molecules in Condensing Argon. Infrared Spectra and Density Functional Calculations of Iron Oxide Product Molecules
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Reactions of Laser-Ablated Nickel Atoms with Dioxygen. Infrared Spectra and Density Functional Calculations of Nickel Oxides NiO, ONiO, Ni2O2, and Ni2O3, Superoxide NiOO, Peroxide Ni(O2), and Higher Complexes in Solid Argon
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Reactions of Laser-Ablated Vanadium Atoms with Dioxygen. Infrared Spectra of VO, VO2, OOVO2, and V2O2 in Solid Argon
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Reactions of Laser-Ablated V, Cr, and Mn Atoms with Nitrogen Atoms and Molecules. Infrared Spectra and Density Functional Calculations on Metal Nitrides and Dinitrogen Complexes
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Reactions of Laser-Ablated Scandium Atoms with Dioxygen. Infrared Spectra of ScO, OScO, (O2)ScO, (ScO)2, and Sc(O2)2 in Solid Argon
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Reactions of Laser-Ablated Chromium Atoms with Nitric Oxide: Infrared Spectra of NCrO, Cr−(η-NO)X (x = 1, 2, 3, 4), and Cr-η-NO in Solid Argon
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Reactions of Laser-Ablated Niobium and Tantalum Atoms with Oxygen Molecules: Infrared Spectra of Niobium and Tantalum Oxide Molecules, Anions, and Cations
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Reactions of Laser-Ablated Molybdenum and Tungsten Atoms with Dioxygen. Resolved Infrared Spectra of Natural Molybdenum and Tungsten Isotopic Oxides in Argon Matrices
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An Infrared Spectroscopic and Density Functional Theoretical Investigation of the Reaction Products of Laser-Ablated Scandium and Titanium Atoms with Nitric Oxide
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Reactions of Laser Ablated Rhodium Atoms with Nitrogen Atoms and Molecules. Infrared Spectra and Density Functional Calculations on Rhodium Nitrides and Dinitrogen Complexes
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Reactions of Laser-Ablated Iridium Atoms with O2. Infrared Spectra and DFT Calculations for Iridium Dioxide and Peroxo Iridium(VI) Dioxide in Solid Argon
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Infrared Spectra and Density Functional Calculations of Small Vanadium and Titanium Carbonyl Molecules and Anions in Solid Neon
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Infrared Spectroscopic and Density Functional Theoretical Investigation of the Reaction Products of Laser-Ablated Zr, Hf, and Th Atoms with Nitric Oxide
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Reactions of Laser-Ablated Rhodium Atoms with O2. Infrared Spectra and DFT Calculations for RhO, ORhO, (O2)RhO2, Rh2O2, Rh(O2) and (O2)Rh(O2) in Solid Argon
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A Further Study of the Products of Scandium and Dioxygen Reactions
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Reactions of Laser-Ablated Y and La Atoms, Cations and Electrons with O2. Infrared Spectra and Density Functional Calculations of the MO, MO+, MO2, MO2+, and MO2- Species in Solid Argon
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Reactions of Laser-Ablated Osmium and Ruthenium Atoms with Nitrogen. Matrix Infrared Spectra and Density Functional Calculations of Osmium and Ruthenium Nitrides and Dinitrides
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Reactions of Methane with Hafnium Atoms: CH2HfH2, Agostic Bonding, and (CH3)2HfH2
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Mass Spectrometric and Photoelectron Spectroscopic Studies of Zirconium Oxide Molecular and Cluster Anions
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A theoretical study of molecular titanium oxide clusters: structure, bonding, vibrations and stability
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Experimental and theoretical study on the reaction Sc + NO → ScO + NPresented at the XIX International Symposium on Molecular Beams, Rome, 3–8 June, 2001.
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Properties of small TiO 2 , ZrO 2 and HfO 2 nanoparticles
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A combined ab initio and Franck–Condon factor simulation study on the photodetachment spectrum of HfO2−
inferred← citeshttps://doi.org/10.1039/b821849hopenalex-snapshot
Characterization of the X 1A1 and à 1B2 electronic states of titanium dioxide, TiO2
inferred← citeshttps://doi.org/10.1039/b916069hopenalex-snapshot
Modelling nano-clusters and nucleation
inferred← citeshttps://doi.org/10.1039/b920033aopenalex-snapshot
Comparative DFT study of structure and magnetism of TMnOm (TM = Sc–Mn, n = 1–2, m = 1–6) Clusters
inferred← citeshttps://doi.org/10.1039/c0cp00861copenalex-snapshot
Visible spectrum of titanium dioxide
inferred← citeshttps://doi.org/10.1039/c1ra00478fopenalex-snapshot
A theoretical search for stable bent and linear structures of low-lying electronic states of the titanium dioxide (TiO2) molecule
inferred← citeshttps://doi.org/10.1039/c2dt31223aopenalex-snapshot
Infrared spectroscopic and theoretical studies of the OTiF2, OZrF2 and OHfF2 molecules with terminal oxo ligands
inferred← citeshttps://doi.org/10.1039/c3cp54084gopenalex-snapshot
High-resolution anion photoelectron spectra of TiO2−, ZrO2−, and HfO2− obtained by slow electron velocity-map imaging
inferred← citeshttps://doi.org/10.1039/c4cp00097hopenalex-snapshot
Experimental and theoretical studies of H 2 O oxidation by neutral Ti 2 O 4,5 clusters under visible light irradiation
inferred← citeshttps://doi.org/10.1039/d0cp02505dopenalex-snapshot
Adsorption and activation of CO 2 on Zr n ( n = 2–7) clusters
inferred← citeshttps://doi.org/10.1063/1.1510119openalex-snapshot
Theoretical study of the Ti+(NO,O2)→TiO+(N,O) reactions
inferred← citeshttps://doi.org/10.1063/1.1516797openalex-snapshot
Rotational spectrum of jet-cooled HfO2 and HfO
inferred← citeshttps://doi.org/10.1063/1.2429062openalex-snapshot
Density functional theory and multireference configuration interaction studies on low-lying excited states of TiO2
inferred← citeshttps://doi.org/10.1063/1.2831583openalex-snapshot
Electronic structure of oxide, peroxide, and superoxide clusters of the 3d elements: A comparative density functional study
inferred← citeshttps://doi.org/10.1063/1.3632053openalex-snapshot
The visible spectrum of zirconium dioxide, ZrO2
inferred← citeshttps://doi.org/10.1063/1.4704127openalex-snapshot
Photoelectron spectroscopy of the molecular anions, ZrO−, HfO−, HfHO−, and HfO2H−
inferred← citeshttps://doi.org/10.1063/1.474637openalex-snapshot
Reactions of laser-ablated chromium atoms with dioxygen. Infrared spectra of CrO, OCrO, CrOO, CrO3, Cr(OO)2, Cr2O2, Cr2O3 and Cr2O4 in solid argon
inferred← citeshttps://doi.org/10.1063/1.475026openalex-snapshot
Electronic structure of titanium oxide clusters: TiOy (y = 1−3) and (TiO2)n (n = 1−4)
inferred← citeshttps://doi.org/10.1063/1.476047openalex-snapshot
On the spectrum and structure of the isolated O4− anion in solid argon
inferred← citeshttps://doi.org/10.1063/1.476547openalex-snapshot
Infrared spectra of cis and trans-(NO)2− anions in solid argon
inferred← citeshttps://doi.org/10.1063/1.478329openalex-snapshot
Infrared spectrum of CCH+ in solid argon and neon
inferred← citeshttps://doi.org/10.1063/1.478418openalex-snapshot
The structures, electron affinities, and energetic stabilities of TiOn and TiOn− (n=1–3)
inferred← citeshttps://doi.org/10.1063/1.478822openalex-snapshot
An infrared spectroscopic and density functional investigation of dinitrogen activation by group IV metal atoms
inferred← citeshttps://doi.org/10.1063/1.4793521openalex-snapshot
Nanochemical effects in femtosecond laser ablation of metals
inferred← citeshttps://doi.org/10.1063/1.479674openalex-snapshot
Fourier transform microwave spectroscopy of jet-cooled ZrO2 produced by laser vaporization
inferred← citeshttps://doi.org/10.1063/1.4942194openalex-snapshot
Gas phase vibrational spectroscopy of cold (TiO2)n− (n = 3–8) clusters
inferred← citeshttps://doi.org/10.1063/1674-0068/cjcp2507104openalex-snapshot
Vibrational resolved photoelectron imaging and theoretical study of the group IVB transition metal oxides anions: MO2− (M=Ti, Zr, and Hf)
inferred← citeshttps://doi.org/10.1063/5.0037636openalex-snapshot
Unveiling the coexistence of cis- and trans -isomers in the hydrolysis of ZrO2: A coupled DFT and high-resolution photoelectron spectroscopy study
inferred← citeshttps://doi.org/10.1063/5.0069094openalex-snapshot
Detection of sub-micrometer thermomechanical and thermochemical failure mechanisms in titanium with a laser-based thermoreflectance technique
inferred← citeshttps://doi.org/10.1080/01442350701685946openalex-snapshot
Probing the intermediates in the MO + CH4↔ M + CH3OH reactions by matrix isolation infrared spectroscopy
inferred← citeshttps://doi.org/10.1080/10420150500215417openalex-snapshot
Thermoluminescence characteristics of hydrogenated amorphous zirconia
inferred← citeshttps://doi.org/10.1080/1539445x.2011.599730openalex-snapshot
Numerical Study of the Zirconium Oxide System
inferred← citeshttps://doi.org/10.1086/528934openalex-snapshot
The Rotational Spectrum of TiO2
inferred← citeshttps://doi.org/10.1088/0953-4075/33/17/319openalex-snapshot
Electronic structure investigation of neutral titanium oxide molecules TixOy
inferred← citeshttps://doi.org/10.1088/0953-8984/24/30/305301openalex-snapshot
Ab initiostudy of neutral (TiO2)nclusters and their interactions with water and transition metal atoms
inferred← citeshttps://doi.org/10.1088/1674-0068/22/02/113-118openalex-snapshot
Formation and Characterization of ZrO3 and HfO3 Molecules in Solid Argon
inferred← citeshttps://doi.org/10.1103/physrevmaterials.2.075001openalex-snapshot
Zirconia and hafnia polymorphs: Ground-state structural properties from diffusion Monte Carlo
inferred← citeshttps://doi.org/10.1111/j.1551-2916.2011.04537.xopenalex-snapshot
Effect of Laser Sintering on Ti–ZrB 2 Mixtures
inferred← citeshttps://doi.org/10.14279/depositonce-234openalex-snapshot
Dust shells around oxygen-rich Miras and long-period variables
inferred← citeshttps://doi.org/10.26434/chemrxiv.13177130.v1openalex-snapshot
Unveiling the Coexistence of Structural Isomers in the Hydrolysis of ZrO2: A Combined Computational and Photoelectron Spectroscopy Study
inferred← citeshttps://doi.org/10.4028/www.scientific.net/amr.507.79openalex-snapshot
Density Functional Theory Study of TinO2n-m Clusters (n=1-4, m=0,1)
inferred← citeshttps://doi.org/10.70675/b7e29c69z5770z44a7zbe71z16b32e4170a7openalex-snapshot
Étude de la réduction de N2O par le mono- et dimère de titane à l'échelle moléculaire : Étude combinée expérimentale par la technique d'isolation en matrice de néon-FTIR et la chimie quantique
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