Physical Chemistry Chemical Physics Journal

Research

keywords

• 02 Physical Sciences, 03 Chemical Sciences

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publication venue for

• Anchoring of a hydrophobic heptapeptide (AFILPTG) on silica facilitates peptide unfolding at the abiotic-biotic interface 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
• Formic acid catalyzed isomerization and adduct formation of an isoprene-derived Criegee intermediate: experiment and theory 2020
• Subpicosecond HI elimination in the 266 nm photodissociation of branched iodoalkanes 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
• Cold and controlled chemical reaction dynamics 2020
• Elementary models of the "flux driven anti-ripening" during nanobelt growth 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
• Ultrafast probes at the interfaces of solar energy conversion materials 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
• Suppression of surfaces states at cubic perovskite (001) surfaces by CO2 adsorption 2018
• The reaction of fluorine atoms with methanol: yield of CH3O/CH2OH and rate constant of the reactions CH3O + CH3O and CH3O + HO2 2018
• Graphene induced electrical percolation enables more efficient charge transport at a hybrid organic semiconductor/graphene interface 2018
• Tailoring electronic properties of multilayer phosphorene by siliconization 2018
• Elucidating sequence and solvent specific design targets to protect and stabilize enzymes for biocatalysis in ionic liquids 2017
• Band gap modulation of SrTiO3 upon CO2 adsorption 2017
• Tuning crystalline ordering by annealing and additives to study its effect on exciton diffusion in a polyalkylthiophene copolymer 2017
• Adatom surface diffusion of catalytic metals on the anatase TiO2(101) surface 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
• Volume dependence of the dielectric properties of amorphous SiO2 2016
• Atmospheric chemistry of (CF3)2C=CH2: OH radicals, Cl atoms and O3 rate coefficients, oxidation end-products and IR spectra. 2015
• A first principles study of CO2 adsorption on alpha-SiO2(001) surfaces 2015
• Adsorption of metal adatoms on single-layer phosphorene 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
• Multiresolution quantum chemistry in multiwavelet bases: excited states from time-dependent Hartree-Fock and density functional theory via linear response 2015
• Phosphorene as an anode material for Na-ion batteries: a first-principles study 2015
• Selective electrochemical reduction of CO2 to CO on CuO-derived Cu nanowires 2015
• Substrate-controlled band positions in CH₃NH₃PbI₃ perovskite films. 2014
• Assessing capability of semiconductors to split water using ionization potentials and electron affinities only 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
• Controlling Na diffusion by rational design of Si-based layered architectures 2014
• High-density biosynthetic fuels: the intersection of heterogeneous catalysis and metabolic engineering 2014
• Red-light initiated atmospheric reactions of vibrationally excited molecules 2014
• Highly soluble energy relay dyes for dye-sensitized solar cells 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 O-2-O-2 collision pairs between 340 and 630 nm and at atmospherically relevant pressure 2013
• DNA mediated assembly of single walled carbon nanotubes: role of DNA linkers and annealing. 2011
• Cold heteromolecular dipolar collisions 2011
• The synergy between qualitative theory, quantitative calculations, and direct experiments in understanding, calculating, and measuring the energy differences between the lowest singlet and triplet states of organic diradicals 2011
• A comparison of fluoroalkyl-derivatized imidazolium:TFSI and alkyl-derivatized imidazolium:TFSI ionic liquids: a molecular dynamics simulation study 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
• The photoelectron spectrum of CCl2-: the convergence of theory and experiment after a decade of debate 2009
• A comparison of ether- and alkyl-derivatized imidazolium-based room-temperature ionic liquids: a molecular dynamics simulation study 2008
• 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 NO(3) absorption cross-section above 298 K and determination of the equilibrium constant for NO(3)+NO(2) <-> N(2)O(5) 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 (2)Sigma(+)(v '=0) to X (2)Pi(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
• Cluster anions: Structure, interactions, and dynamics in the sub-nanoscale regime 2004
• Vibrational deactivation studies of OH X2Π (v = 1–5) by N2and O2 2004
• Electronic spectroscopy and photophysics of 2-(N-methyl-N-isopropylamino)-5-cyanopyridine and related compounds 2003
• 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