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101 Armentrout, Peter B.Guided ion beam and theoretical study of the reactions of Os + with H 2, D 2, and HDReactions of the third-row transition metal cation Os+ with H2, D2, and HD to form OsH+ (OsD+) were studied using a guided ion beam tandem mass spectrometer. A flow tube ion source produces Os+ in its 6D (6s15d6) electronic ground state level. Corresponding state-specific reaction cross sections are...2011
102 Armentrout, Peter B.Guided ion beam studies of the reaction of Nin+ (n=2-16) with D2: nickel cluster-deuteride bond energiesThe kinetic-energy dependences of the reactions of Nin+ (n=2-16) with D2 are studied in a guided ion beam tandem mass spectrometer. The products observed are NinD+ for all clusters and NinD2 + for n=5-16. Reactions for formation of NinD+ are observed to exhibit thresholds, whereas cross sections for...Metal clusters; Nickel ions; Bond energies; Deuterides; Collision-induced dissociation; Endothermic reactions2002
103 Armentrout, Peter B.Guided ion beam studies of the reactions of Crn + (n=2-18) with O2: chromium cluster oxide and dioxide bond energiesThe kinetic energy dependence of the reactions of Crn+ (n=2-18) with O2 are studied in a guided ion beam mass spectrometer. A variety of CrmO2+, CrmO+, and Crm+ product ions, where m≤n, are observed, with the dioxide cluster ions dominating the products for all larger reactant cluster ions. React...Metal clusters; Chromium ions; Oxygen; Oxygen; Bond energies; Exothermic reactions1998
104 Armentrout, Peter B.Guided ion beam studies of the reactions of Crn+ (n=1-18) with CO2: chromium cluster oxide bond energiesThe kinetic energy dependence of the reactions of Crn+ (n=1-18) with CO2 are studied in a guided ion beam mass spectrometer. The primary product ions are CrnO+, which then decompose by sequential loss of chromium atoms as the kinetic energy is increased. Simple collision-induced dissociation to form...Metal clusters; Chromium ions; Oxygen; Bond energies; Exothermic reactions; Endothermic reactions1998
105 Armentrout, Peter B.Guided ion beam studies of the reactions of Nin+ (n=2-18) with O2: nickel cluster oxide and dioxide bond energiesThe kinetic energy dependences of the reactions of Nin + (n=2 - 18) with O2 are studied in a guided ion beam tandem mass spectrometer. A variety of NimO2+, NimO+, and Nim+ product ions, where m<n, are observed, with the dioxide cluster ions dominating the products for all larger reactant cluster io...Metal clusters; Nickel oxide; Nickel dioxide; Bond energies; Collision-induced dissociation; Exothermic reactions2003
106 Armentrout, Peter B.Guided ion beam studies of the reactions of Vn+ (n = 2-13) with D2: cluster-deuteride bond energies as a chemical probe of cluster electronic structureThe kinetic energy dependencies of the reactions of Vn+ (n=2 - 13) with D2 are studied in a guided ion beam tandem mass spectrometer. Products observed are VnD1 for all clusters and VnD2 + for n=4 - 13. All reactions are observed to exhibit thresholds, except for formation of VnD2 + for n =4,5,7,9,1...Metal clusters; Vanadium ions; Bond energies; Endothermic reactions; Collision-induced dissociation; Transition metal ions; Deuterides2002
107 Armentrout, Peter B.Guided ion beam study of collision-induced dissociation dynamics: integral and differential cross sectionsThe low energy collision-induced dissociation (CID) of Cr(CO)6+ with Xe is investigated using a recently modified guided ion beam tandem mass spectrometer, in the energy range from 0 to 5 eV in the center-of-mass (CM) frame. The additions to the instrument, updated with a double octopole system, and...Collision-induced dissociation; Bond energies; Chromium carbonyl; Xenon2001
108 Armentrout, Peter B.Guided ion-beam studies of the kinetic-energy-dependent reactions of Con+ (n=2-16) with D2: cobalt cluster-deuteride bond energiesThe kinetic-energy-dependent cross sections for the reactions of Con + (n=2-16) with D2 are measured as a function of kinetic energy over a range of 0-8 eV in a guided ion-beam tandem mass spectrometer. The observed products are ConD+ for all clusters and ConD2+ for n=4,5,9-16.Cobalt ions; Metal clusters; Deuteride; Collision-induced dissociation; Endothermic reactions; Bond energies2005
109 Armentrout, Peter B.Guided ion-beam studies of the reactions of Con + (n=2-20) with O2: cobalt cluster-oxide and -dioxide bond energiesThe kinetic-energy dependence for the reactions of Con + (n=2-20) with O2 is measured as a function of kinetic energy over a range of 0 to 10 eV in a guided ion-beam tandem mass spectrometer. A variety of Com+ , ComO+, and ComO2 + (m<n) product ions is observed, with the dioxide cluster ions domina...Metal clusters; Cobalt ions; Collision-induced dissociation; Bond energies; Exothermic reactions; Endothermic reactions2005
110 Truong, ThanhHigh level ab initio and density functional theory evaluation of combustion reaction energetics: NO2 and HONO elimination from dimethylnitramineDimethylnitramine (DMNA) is used as a model system for investigating accurate and efficient electronic structure methods for nitramines. Critical points on the potential energy surfaces of DMNA, CH3NCH3, CH3NCH2, NO2, HONO, and the transition state to HONO elimination were located through geometry o...Dimethylnitramine; DMNA; Nitramines; Combustion reaction energetics1999
111 Minteer, Shelley D.High performance glucose/O2 biofuel cell: effect of utilizing purified laccase with anthracene-modified multi-walled carbon nanotubesLaccase, a blue multicopper oxidoreductase enzyme, is a robust enzyme that catalyzes the reduction of oxygen to water and has been shown previously to perform improved direct electron transfer in a biocathode when mixed with anthracene-modified multi-walled carbon nanotubes. Previous cathode constru...2012-01-01
112 Armentrout, Peter B.Hydrogen atom transfer reactions of He+ and Ne+ with H2, D2, and HDThe hydrogen atom transfer reactions of helium (1 +) and neon(1+) ions with isotopic molecular hydrogen (H2 , D2 , and HD) are investigated using guided ion beam techniques. These reactions are exothermic, but are known to be extremely slow at thermal energies. The cross sections for formation of...Transfer reactions; Ion-molecule reactions; Exothermic reactions; Hydrogen; Helium ions; Neon ions; Threshold behavior; Isotope effects1987
113 Armentrout, Peter B.IR spectroscopy of cationized aliphatic amino acids: stability of charge-solvated structure increases with metal cation sizeAbstract Gas-phase structures of alkali metal cationized (Li+, Na+, K+, Rb+, Cs+) proline (Pro) and N-methyl alanine have been investigated using infrared multiple photon dissociation (IRMPD) spectroscopy utilizing light generated by a free electron laser and computational modeling. Measured IRMPD...2010-11
114 Voth, Gregory Alan; Sarofim, Adel F.Identification of pathways for polyaromatic growth using molecular dynamicsReaction pathways for polyaromatic growth in combustion environments are explored theoretically using molecular dynamic techniques. The reaction systems considered include cyclization reactions that involve H atom migration. Specifically we examine the absorption of acetylene on an aromatic ring rad...2004
115 Truong, ThanhImportance of polarization in simulations of condensed phased energetic materialsAn embedded cluster model is used to estimate the molecular dipole moment of crystalline dimethylnitramine (DMNA). The electrostatic potential due to the crystal is included in the calculation via the SCREEP (surface charge representation of the electrostatic embedding potential) approach. The resul...Dimethylnitramine; DMNA; Embedded cluster model1999
116 Minteer, Shelley D.Improved performance of a thylakoid bio-solar cell by incorporation of carbon quantum dotsCarbon quantum dots (CQDs) were incorporated into thylakoid bioanodes capable of direct photobioelectrocatalysis in order to increase the photocurrent generation. More thylakoids are in contact with the increased surface area which allows for greater direct electron transfer (DET). Additionally, the...2014-01-01
117 Minteer, Shelley D.In recognition of Adam Heller and his enduring contributions to electrochemistryRecent progress in diverse scientific fields ranging from bioelectrochemistry to battery technology to photoconversion has been deeply influenced by the contributions of Professor Adam Heller of the University of Texas at Austin to electrochemistry and materials science. This focus issue recognizes ...2014-01-01
118 Stang, Peter J.Incorporation of flexible pyridine-functionalized ligands into discrete supramolecules via coordination-driven self-assemblyFlexible, pyridine-functionalized ligands were self-assembled into discrete supramolecules of differing stoichiometries upon combination with various organoplatinum molecules. They are characterized by electrospray ionization mass spectrometry, 31P(iHI and 'H NMR. Despite its inherent flexibility, 3...Self-assembly; Coordination-driven; Transition-metal-mediated; Flexible ligands; Pyridyl ligands; Supramolecules2004
119 Morse, Michael DavidInfrared diode laser spectroscopy of jet-cooled NiCO, Ni(CO)?(??CO), and NI(CO)?(c??O)Gas phase infrared spectroscopic investigations of the CO vibration of jet-cooled NiCO, Ni(CO)3(13CO), and Ni(CO)3(C18O) are reported. The spectra were obtained using a recently assembled pulsed-discharge slit-jet IR diode laser spectrometer. The rotationally resolved spectrum of NiCO was collected ...2006
120 Armentrout, Peter B.Infrared multiple photon dissociation spectroscopy of cationized cysteine: effects of metal cation size on gas-phase conformationAbstract The gas-phase structures of cationized cysteine (Cys) including complexes with Li+, Na+, K+, Rb+, and Cs+, as well as protonated Cys, are examined by infrared multiple photon dissociation (IRMPD) action spectroscopy utilizing light generated by a free electron laser, in conjunction with q...2010
121 Armentrout, Peter B.Infrared multiple photon dissociation spectroscopy of cationized methionine: effects of alkali-metal cation size on gas-phase conformationPlease note that as of 11-07-2012, access to this article through USpace had to be restricted. The gas-phase structures of alkali-metal cation complexes of the amino acid methionine (Met) as well as protonated methionine are investigated using infrared multiple photon dissociation (IRMPD) spectros...2010
122 Armentrout, Peter B.Infrared multiple photon dissociation spectroscopy of protonated histidine and 4-phenyl imidazoleThe gas-phase structures of protonated histidine (His) and the side-chain model, protonated 4-phenyl imidazole (PhIm), are examined by infrared multiple photon dissociation (IRMPD) action spectroscopy utilizing light generated by the free electron laser FELIX. To identify the structures present in t...2012-01-01
123 Miller, Joel StevenInnovation in crystal engineeringThe first CrystEngComm discussion meeting on crystal engineering has demonstrated that the field has reached maturity in some areas (for example: design strategies, characterization of solid compounds, topological analysis of weak and strong non-covalent interactions), while the quest for novel pro...Research; Design; Molecular2002
124 Morse, Michael DavidInteraction of an aluminum atom with a closed subshell metal atom: spectroscopic analysis of AIZnResonant two-photon ionization spectroscopy has been employed to investigate diatomic AlZn produced by laser vaporization of a 1:2 Al:Zn alloy target disk in a supersonic expansion of helium. Several discrete transitions are reported in the energy range from 18 400 to 19 100 cm-?. Most of these are...1994
125 Morse, Michael DavidInteraction of an aluminum atom with an alkaline earth atom: spectroscopic and ab initio investigations of AICaA spectroscopic analysis of diatomic AlCa generated by laser vaporization of a 2:1 AI:Ca metal alloy followed by supersonic expansion has been completed using resonant two-photon ionization spectroscopy. Four excited electronic states have been identified and investigated in the energy region from 1...1994
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