Physical Chemistry Chemical Physics | CU Experts

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IR spectra of cationic 1,5,9-triazacoronene and two of its cationic derivatives. 2024
Laser-induced fragmentation of coronene cations. 2024
Photoprocessing of cationic triazacoronene: dissociation characteristics of polycyclic aromatic nitrogen heterocycles in interstellar environments 2024
Surface doping of rubrene single crystals by molecular electron donors and acceptors 2023
Threshold photoelectron spectroscopy and dissociative photoionization of benzonitrile 2023
Incorporating ion-specific van der Waals and soft repulsive interactions in the Poisson-Boltzmann theory of electrical double layers 2023
Informing air-carbon ablation modeling with theoretical calculations of atomic oxygen and nitrogen interacting with carbon surfaces 2023
X-ray absorption spectroscopy insights on the structure anisotropy and charge transfer in Chevrel Phase chalcogenides 2022
Infrared spectroscopy of 2-oxo-octanoic acid in multiple phases 2022
Solvent and cosolute dependence of Mg surface enrichment in submicron aerosol particles 2022
Formation of phenylacetylene and benzocyclobutadiene in the ortho-benzyne plus acetylene reaction 2022
The electron-transfer intermediates of the oxygen evolution reaction (OER) as polarons by in situ spectroscopy 2021
Anchoring of a hydrophobic heptapeptide (AFILPTG) on silica facilitates peptide unfolding at the abiotic-biotic interface 2021
Diazaphospholenes as reducing agents: a thermodynamic and electrochemical DFT study 2021
Application-specific thermodynamic favorability zones for direct air capture of carbon dioxide 2021
Theoretical and experimental study of peroxy and alkoxy radicals in the NO₃-initiated oxidation of isoprene 2021
Kinetic fall-off behavior for the Cl + Furan-2,5-dione (C₄H₂O₃, maleic anhydride) reaction 2021
The primary photo-dissociation dynamics of lactate in aqueous solution: decarboxylation prevents dehydroxylation 2021
Formic acid catalyzed isomerization and adduct formation of an isoprene-derived Criegee intermediate: experiment and theory 2020
Single-molecule kinetic studies of DNA hybridization under extreme pressures 2020
Intrinsic electronic spectra of cryogenically prepared protoporphyrin IX ionsin vacuo- deprotonation-induced Stark shifts 2020
Isomer-selected ion-molecule reactions of acetylene cations with propyne and allene 2020
High pressure single-molecule FRET studies of the lysine riboswitch: cationic and osmolytic effects on pressure induced denaturation 2020
Cold and controlled chemical reaction dynamics 2020
Atmospheric loss of nitrous oxide (N₂O) is not influenced by its potential reactions with OH and NO₃ radicals 2019
Molecular p-doping in organic liquid crystalline semiconductors: influence of the charge transfer complex on the properties of mesophase and bulk charge transport 2019
From phage display to structure: an interplay of enthalpy and entropy in the binding of the LDHSLHS polypeptide to silica 2019
Kinetics of the reactions of NO3 radical with alkanes 2019
Intrinsic photophysics of nitrophenolate ions studied by cryogenic ion spectroscopy 2018
Photoelectron spectroscopy and thermochemistry of o-, m-, and p-methylenephenoxide anions 2018
The reaction of fluorine atoms with methanol: yield of CH₃O/CH₂OH and rate constant of the reactions CH₃O + CH₃O and CH₃O + HO₂ 2018
Reactivity of amino acid anions with nitrogen and oxygen atoms 2018
Graphene induced electrical percolation enables more efficient charge transport at a hybrid organic semiconductor/graphene interface 2018
Elucidating sequence and solvent specific design targets to protect and stabilize enzymes for biocatalysis in ionic liquids 2017
Tuning crystalline ordering by annealing and additives to study its effect on exciton diffusion in a polyalkylthiophene copolymer 2017
In situ probing of the crystallization kinetics of rr-P3HT on single layer graphene as a function of temperature 2017
Adatom surface diffusion of catalytic metals on the anatase TiO₂(101) surface 2017
Facile pentagon formation in the dissociation of polyaromatics. 2017
Variation of excited-state dynamics in trifluoromethyl functionalized C-60 fullerenes 2016
Sunlight as an energetic driver in the synthesis of molecules necessary for life 2016
Atmospheric fates of Criegee intermediates in the ozonolysis of isoprene 2016
Atmospheric chemistry of (CF₃)₂C=CH₂: OH radicals, Cl atoms and O₃ rate coefficients, oxidation end-products and IR spectra 2015
Competition between electron transfer, trapping, and recombination in CdS nanorod-hydrogenase complexes 2015
Gas-phase spectroscopy of singly reduced tris(bipyridine)ruthenium ions, Ru(bipy)₃⁺ 2015
Improved charge separation via Fe-doping of copper tungstate photoanodes 2015
Ligand influence on the electronic spectra of monocationic copper-bipyridine complexes 2015
Mechanism of the hydroxyl radical oxidation of methacryloyl peroxynitrate (MPAN) and its pathway toward secondary organic aerosol formation in the atmosphere 2015
Multiresolution quantum chemistry in multiwavelet bases: excited states from time-dependent Hartree-Fock and density functional theory via linear response 2015
Selective electrochemical reduction of CO₂ to CO on CuO-derived Cu nanowires 2015
Sequential "click'' functionalization of mesoporous titania for energy-relay dye enhanced dye-sensitized solar cells 2015
Substrate-controlled band positions in CH₃NH₃PbI₃ perovskite films. 2014
Anionic derivatives of uracil: fragmentation and reactivity 2014
Adsorption studies of a phosphonic acid on ITO: film coverage, purity, and induced electronic structure changes 2014
Assessing capability of semiconductors to split water using ionization potentials and electron affinities only 2014
Chirped-pulse millimeter-wave spectroscopy for dynamics and kinetics studies of pyrolysis reactions 2014
Competing atmospheric reactions of CH₂OO with SO₂ and water vapour 2014
Complex refractive indices in the near-ultraviolet spectral region of biogenic secondary organic aerosol aged with ammonia 2014
High-density biosynthetic fuels: the intersection of heterogeneous catalysis and metabolic engineering 2014
Melt-infiltration of spiro-OMeTAD and thermal instability of solid-state dye-sensitized solar cells 2014
Red-light initiated atmospheric reactions of vibrationally excited molecules 2014
Tetracyano isoindigo small molecules and their use in n-channel organic field-effect transistors 2014
Gas-phase reactions of the atomic oxygen radical cation with halogenated compounds 2013
Highly soluble energy relay dyes for dye-sensitized solar cells 2013
Highly soluble energy relay dyes for dye-sensitized solar cells (vol 15, pg 11306, 2013) 2013
Radical diffusion limits to photoinhibited superresolution lithography 2013
Recent developments in the photophysics of single-walled carbon nanotubes for their use as active and passive material elements in thin film photovoltaics 2013
Solution-processed small molecule:fullerene bulk-heterojunction solar cells: impedance spectroscopy deduced bulk and interfacial limits to fill-factors 2013
Stability, surface features, and atom leaching of palladium nanoparticles: toward prediction of catalytic functionality 2013
Temperature dependent absorption cross-sections of O₂-O₂ collision pairs between 340 and 630 nm and at atmospherically relevant pressure 2013
Direct correlation between work function of indium-tin-oxide electrodes and solar cell performance influenced by ultraviolet irradiation and air exposure 2012
The importance of dye chemistry and TiCl4 surface treatment in the behavior of Al2O3 recombination barrier layers deposited by atomic layer deposition in solid-state dye-sensitized solar cells 2012
Tracking energy transfer from excited to accepting modes: application to water bend vibrational relaxation 2012
DNA mediated assembly of single walled carbon nanotubes: role of DNA linkers and annealing. 2011
Bias-stress effects in organic field-effect transistors based on self-assembled monolayer nanodielectrics 2011
Cold heteromolecular dipolar collisions 2011
Is it cubic? Ice crystallization from deeply supercooled water 2011
Non-monotonic dependence of water reorientation dynamics on surface hydrophilicity: competing effects of the hydration structure and hydrogen-bond strength 2011
Water reorientation dynamics in the first hydration shells of F^- and I^- 2011
Computational studies of gas phase reactions of carbon chain anions with N and O atoms 2010
Dissociation of nitric acid at an aqueous surface: Large amplitude motions in the contact ion pair to solvent-separated ion pair conversion 2010
Excited-state dynamics and dye-dye interactions in dye-coated gold nanoparticles with varying alkyl spacer lengths 2010
Freezing, melting and structure of ice in a hydrophilic nanopore 2010
Studies of one and two component aerosols using IR/VUV single particle mass spectrometry: Insights into the vaporization process and quantitative limitations 2010
A dipolar gas of ultracold molecules 2009
A study of oleic acid and 2,4-DHB acid aerosols using an IR-VUV-ITMS: insights into the strengths and weaknesses of the technique 2009
Adsorption of peptides (A3, Flg, Pd2, Pd4) on gold and palladium surfaces by a coarse-grained Monte Carlo simulation 2009
Kinetics of the heterogeneous conversion of 1,4-hydroxycarbonyls to cyclic hemiacetals and dihydrofurans on organic aerosol particles 2009
Photodamage to isolated mononucleotides-photodissociation spectra and fragment channels 2009
CF₃CF=CH₂ and (Z)-CF₃CF=CHF:: temperature dependent OH rate coefficients and global warming potentials 2008
Dipolar molecular rotors in the metal-organic framework crystal IRMOF-2 2008
Experimental and theoretical studies of the reaction of the OH radical with alkyl sulfides: 2. Kinetics and mechanism of the OH initiated oxidation of methylethyl and diethyl sulfides; observations of a two channel oxidation mechanism 2007
Temperature dependence of the NO₃ absorption cross-section above 298 K and determination of the equilibrium constant for NO₃+NO₂ ⇆ N₂O₅ at atmospherically relevant conditions 2007
Vibrational overtone induced elimination reactions within hydrogen-bonded molecular clusters: the dynamics of water catalyzed reactions in CH2FOH center dot(H2O) 2007
Absorption cross sections for the (A)over-tilde(2)A ''(0,9(0),0)<-(X)over-tilde(2)A '(0,0(1),0) band of the HCO radical 2006
Branching ratios for quenching of nitric oxide A ²Σ⁺(v′=0) to X ²Π(v"=0) 2006
Light stability of pyrazolotriazole azamethine dyes at oil/aqueous interfaces 2005
Quantum yields of OH, HO2 and NO3 in the UV photolysis of HO2NO2 2005
Vibrational deactivation studies of OH X ²Π (ν=1-5) by N₂ and O₂ 2004
Study on diffusion behavior of water in epoxy resins cured by active ester 2003
Aggregation of azamethine dyes on hydrated glass surfaces: An evanescent wave-induced fluorescence study 2002
OH-initiated oxidation of benzene - Part I. Phenol formation under atmospheric conditions 2002
OH-initiated oxidation of benzene - Part II. Influence of elevated NOx concentrations 2002
Oxyhalogen-sulfur chemistry: Kinetics and mechanism of the oxidation of a Bunte salt 2-aminoethanethiolsulfuric acid by chlorite 2001
Spontaneous fission of atmospheric aerosol particles 2001
Thin film properties and surface morphology of metal free phthalocyanine films grown by organic molecular beam deposition 1999

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