publication venue for

• Modeling the Mechanics of Polymer Chains with Deformable and Active Bonds 2020
• The Impact of Huge Structural Changes on Electron Transfer and Measurement of Redox Potentials: Reduction of ortho-12-Carborane 2019
• Chemically Selective Transport in a Cross-Linked H-II Phase Lyotropic Liquid Crystal Membrane 2019
• Intramolecular Fluorescent Protein Association in a Class of Zinc FRET Sensors Leads to Increased Dynamic Range 2019
• Understanding the Nanoscale Structure of Inverted Hexagonal Phase Lyotropic Liquid Crystal Polymer Membranes 2019
• Renewable Hydride Donors for the Catalytic Reduction of CO2: A Thermodynamic and Kinetic Study 2018
• Predicting Hydride Donor Strength via Quantum Chemical Calculations of Hydride Transfer Activation Free Energy 2018
• Mechanism of Competitive Inhibition and Destabilization of Acidothermus cellulolyticus Endoglucanase 1 by Ionic Liquids 2017
• Mechanism of competitive inhibition and destabilization of Acidothermus; Cellulolyticus Endoglucanase 1 by ionic liquids 2017
• Mechanism of competitive inhibition and destabilization of Acidothermus; Cellulolyticus Endoglucanase 1 by ionic liquids 2017
• Effect of Conformational Chirality on Optical Activity Observed in a Smectic of Achiral, Bent-Core Molecules 2017
• Aminopolymer Mobility and Support Interactions in Silica-PEI Composites for CO2 Capture Applications: A Quasielastic Neutron Scattering Study 2017
• Dihydropteridine/Pteridine as a 2H(+)/2e(-) Redox Mediator for the Reduction of CO2 to Methanol: A Computational Study 2017
• Study of the Impact of Polyanions on the Formation of Lipid Bilayers on Top of Polyelectrolyte Multilayers with Poly(allylamine hydrochloride) as the Top Layer 2017
• The Dynamics of Water in Porous Two-Dimensional Crystals 2017
• Phototropic Guest-Host Liquid Crystal Systems: Environmental Effects on Naphthopyran Kinetics 2016
• The Partitioning of Small Aromatic Molecules to Air-Water and Phospholipid Interfaces Mediated by Non-Hydrophobic Interactions 2016
• Acetylation of Surface Lysine Groups of a Protein Alters the Organization and Composition of Its Crystal Contacts 2016
• Lytic Polysaccharide Monooxygenases ScLPMO10B and ScLPMO10C Are Stable in Ionic Liquids As Determined by Molecular Simulations 2016
• Atomistic Simulation of Stacked Nucleosome Core Particles: Tail Bridging, the H4 Tail, and Effect of Hydrophobic Forces 2016
• Interaction of L-Phenylalanine with a Phospholipid Monolayer at the Water-Air Interface 2015
• Photoinduced Carrier Generation and Recombination Dynamics of a Trilayer Cascade Heterojunction Composed of Poly(3-hexylthiophene), Titanyl Phthalocyanine, and C-60 2015
• Measurements of Single Nucleotide Electronic States as Nanoelectronic Fingerprints for Identification of DNA Nucleobases, Their Protonated and Unprotonated States, Isomers, and Tautomers 2015
• Measurements of single nucleotide electronic states as nanoelectronic fingerprints for identification of DNA nucleobases, their protonated and unprotonated states, isomers, and tautomers. 2015
• Kinetic and Thermodynamic Origins of Osmolyte-Influenced Nucleic Acid Folding 2015
• The Tunable Hydrophobic Effect on Electrically Doped Graphene 2014
• Mediating Electrostatic Binding of 1-Butyl-3-methylimidazolium Chloride to Enzyme Surfaces Improves Conformational Stability 2013
• Toward Designed Singlet Fission: Solution Photophysics of Two Indirectly Coupled Covalent Dimers of 1,3-Diphenylisobenzofuran 2013
• Near-IR Resonance Raman Spectroscopy of Archaerhodopsin 3: Effects of Transmembrane Potential 2012
• A Microscopic Model of Singlet Fission 2012
• Configurational Preferences of Arylamide alpha-Helix Mimetics via Alchemical Free Energy Calculations of Relative Binding Affinities 2012
• Pressure-Induced Changes in the Fluorescence Behavior of Red Fluorescent Proteins 2012
• Hydrophobic Collapse of a Stearic Acid Film by Adsorbed L-Phenylalanine at the Air-Water Interface 2012
• Dynamical Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water 2011
• Separating homogeneous and inhomogeneous line widths of heavy- and light-hole excitons in weakly disordered semiconductor quantum wells. 2011
• Homeotropic Alignment and Director Structures in Thin Films of Triphenylamine-Based Discotic Liquid Crystals Controlled by Supporting Nanostructured Substrates and Surface Confinement 2011
• Maximizing Singlet Fission in Organic Dimers Theoretical Investigation of Triplet Yield in the Regime of Localized Excitation and Fast Coherent Electron Transter 2010
• Singlet Exciton Fission for Solar Cell Applications Energy Aspects of Interchromophore Coupling 2010
• Phospholipid Diffusion at the Oil-Water Interface 2010
• Self-Assembly of Linactants: Micelles and Lyotropic Liquid Crystals in Two Dimensions 2010
• Mechanism of Cdc25B Phosphatase with the Small Molecule Substrate p-Nitrophenyl Phosphate from QM/MM-MFEP Calculations 2009
• Large Negative Differential Resistance in a Molecular Junction of Carbon Nanotube and Anthracene 2008
• Raman spectroscopy reveals direct chromophore interactions in the Leu/Gln105 spectral tuning switch of proteorhodopsins. 2008
• The subdiffusive targeting problem. 2008
• Heterogeneous nucleation of nitric acid trihydrate on clay minerals: Relevance to Type Ia polar stratospheric clouds 2008
• Ion chemistry of 1H-1,2,3-Triazole 2008
• Vibrational spectroscopy of perfluorocarboxylic acids from the infrared to the visible regions 2008
• Accurate and efficient corrections for missing dispersion interactions in molecular Simulations 2007
• Subpicosecond protein backbone changes detected during the green-absorbing proteorhodopsin primary photoreaction. 2007
• Fatty-acid monolayers at the nematic/water interface: Phases and liquid-crystal alignment 2007
• Calculation of relative energies of permethylated oligosilane conformers in vapor and in alkane solution 2006
• Kinetics of PL quenching during single-walled carbon nanotube rebundling and diameter-dependent surfactant interactions 2006
• Nanocrystalline TiO2 solar cells sensitized with InAs quantum dots 2006
• Photoinduced charge carrier generation in a poly(3-hexylthiophene) and methanofullerene bulk heterojunction investigated by time-resolved terahertz spectroscopy 2006
• Self-assembly of linear arrays of semiconductor nanoparticles on carbon single-walled nanotubes 2006
• Time-resolved photoconductivity of PbSe nanocrystal arrays 2006
• Autobiography and Scientific History of Arthur J. Nozik 2006
• Influence of surface area on charge transport and recombination in dye-sensitized TiO2 solar cells. 2006
• Dynamics of alkyl ammonium intercalants within organically modified montmorillonite: Dielectric relaxation and ionic conductivity 2006
• Electron Transfer Driven by Proton Fluctuations in a Hydrogen-Bonded Donor−Acceptor Assembly 2006
• Mechanistic study of the electrochemical oxygen reduction reaction on Pt(111) using density functional theory 2006
• Depth and angular profiles of inelastic low-energy electron scattering in condensed molecular samples 2006
• Dependence of band offset and open-circuit voltage on the interfacial interaction between TiO2 and carboxylated polythiophenes 2006
• Wall "thickness" effects on Raman spectrum shift, thermal conductivity, and Young's modulus of single-walled nanotubes 2005
• Effect of a coadsorbent on the performance of dye-sensitized TiO2 solar cells: shielding versus band-edge movement. 2005
• Charge separation in heterostructures of InP nanocrystals with metal particles 2005
• Quenching of semiconductor quantum dot photoluminescence by a pi-conjugated polymer 2005
• Size-dependent formation enthalpy of nanocompounds 2005
• Absorption cross-section and related optical properties of colloidal InAs quantum dots 2005
• Electron and hole transfer from indium phosphide quantum dots 2005
• Atomic charges for classical simulations of polar systems 2004
• Quantum chemistry based statistical mechanical model of hydrogen desorption from Si(100)-2 x 1, Ge(100)-2 x 1, and SiGe alloy surfaces 2004
• Atomic layer deposition of HfO2 using alkoxides as precursors 2004
• Off-lattice simulation of multifunctional monomer polymerizations: Effects of monomer mobility, structure, and functionality on structural evolution at low conversion 2004
• A density functional theory study on the effect of Ge alloying on hydrogen desorption from SiGe alloy surfaces 2004
• A quantum chemical study of the atomic layer deposition of Al2O3 using AlCl3 and H2O as precursors 2004
• Observation of Proton-Coupled Electron Transfer by Transient Absorption Spectroscopy in a Hydrogen-Bonded, Porphyrin Donor−Acceptor Assembly 2004
• Oxygen Permeability of Fully Condensed Lipid Monolayers 2004
• Mode-selective optical Kerr effect spectroscopy 2004
• Enhanced sensitivity in single-reflection spectroscopy of organic monolayers on metal substrates (Pseudo-ATR) 2004
• Chemical imaging of photoresists with coherent anti-Stokes Raman scattering (CARS) microscopy 2004
• Electron transfer dynamics in quantum dot/titanium dioxide composites formed by in situ chemical bath deposition 2003
• Reactions of nitriles at semiconductor surfaces 2003
• Photoenhancement of luminescence in colloidal CdSe quantum dot solutions 2003
• Quantum chemical study of zirconium oxide deposition on the Si(100)-(2x1) surface 2003
• Editorial note to the Arnim Henglein Festschrift 2003
• Reactions of cyclic aliphatic and aromatic amines on Ge(100)-2x1 and Si(100)-2x1 2003
• Isothermal desorption kinetics of crystalline H2O, (H2O)-O-18, and D2O ice multilayers 2003
• Electron relaxation in colloidal InP quantum dots with photogenerated excitons or chemically injected electrons 2003
• Carrier localization and cooling in dye-sensitized nanocrystalline titanium dioxide 2002
• Excitation energy dependent efficiency of charge carrier relaxation and photoluminescence in colloidal InP quantum dots 2002
• Terahertz spectroscopy 2002
• Electron and hole adducts formed in illuminated InP colloidal quantum dots studied by electron paramagnetic resonance 2002
• Effects of solvent quality during polymerization on network structure of cross-linked methacrylate copolymers 2002
• Density functional theory study of atomic nitrogen on the Si(100)-(2 x 1) surface 2002
• Continuous-wave and time-resolved optically detected magnetic resonance studies of nonetched/etched InP nanocrystals 2002
• Example of a thermodynamically controlled reaction on a semiconductor surface: Acetone on Ge(100)-2 x 1 2001
• Topological disorder and reactivity of borosilicate glasses: Quantum chemical calculations and O-17 and B-11 NMR study 2001
• DFT study of the adsorption of chlorosilanes on the Si(100)-2 x 1 surface 2001
• Synthesis and Characterization of a Poly(1,3-dithienylisothianaphthene) Derivative for Bulk Heterojunction Photovoltaic Cells 2001
• A statistical kinetic model for the bulk degradation of PLA-b-PEG-b-PLA hydrogel networks: Incorporating network non-idealities 2001
• A generalized bulk-degradation model for hydrogel networks formed from multivinyl cross-linking molecules 2001
• Effect of a methyl-protecting group on the adsorption of pyrrolidine on Si(100)-2 x 1 2001
• Core-shell quantum dots of lattice-matched ZnCdSe2 shells on InP cores: Experiment and theory 2000
• Evolution of a steady state island size distribution during self-assembled monolayer dissolution 2000
• A statistical kinetic model for the bulk degradation of PLA-b-PEG-b-PLA hydrogel networks 2000
• Mechanism governing microparticle morphology during precipitation by a compressed antisolvent: Atomization vs nucleation and growth 2000
• Ab initio study of adsorption and decomposition of NH3 on Si(100)-(2x1) 2000
• A wave packet model for electron transfer and its implications for the semiconductor-liquid interface 1999
• Cycloaddition of cyclopentadiene and dicyclopentadiene on Si(100)-2x1: Comparison of monomer and dimer adsorption 1999
• Effect of HNO3 and HCl on HDO diffusion on crystalline D2O ice multilayers 1999
• Femtosecond IR study of excited-state relaxation and electron-injection dynamics of Ru(dcbpy)(2)(NCS)(2) in solution and on nanocrystalline TiO2 and Al2O3 thin films 1999
• Fast electron transfer across semiconductor-molecule interfaces: GaAs/Co(Cp)(2)(+/0) 1999
• Allen J. Bard Festschrift - A personal note 1998
• Optical, electronic, and structural properties of uncoupled and close-packed arrays of InP quantum dots 1998
• Toward a square grid polymer: Electrochemistry of tentacled tetragonal star connectors, C4R4-Co-C-5(HgY)(5), on mercury 1998
• Adsorption of H2O on a single-crystal alpha-Al2O3(0001) surface 1998
• A conformational phase transition in a Langmuir film of an amphiphilic azacrown 1998
• Dynamics of electron injection in nanocrystalline titanium dioxide films sensitized with [Ru(4,4 '-dicarboxy-2,2 '-bipyridine)(2)(NCS)(2)] by infrared transient absorption 1998
• Molecular dipole chains: Excitations and dissipation 1998
• Infrared resonant desorption of H2O from ice multilayers 1998
• Experimental studies of vapor-deposited water-ice firms using grazing-angle FTIR-reflection absorption spectroscopy 1997
• Kinetics of self-assembled monolayer growth explored via submonolayer coverage of incomplete films 1997
• Electron transfer rate constants for majority electrons at GaAs and GaInP2 semiconductor-liquid interfaces 1997
• Water core within perfluoropolyether-based microemulsions formed in supercritical carbon dioxide 1997
• Diffusion of HDO into single-crystal (H2O)-O-16 ice multilayers: Comparison with (H2O)-O-18 1997
• Size-dependent spectroscopy of InP quantum dots 1997
• Charge recombination in dye-sensitized nanocrystalline TiO2 solar cells 1997
• Heinz Gerischer - March 31, 1919 September 14, 1994 1997
• Heinz Gerischer - March 31, 1919 September 14, 1994 - Biography 1997
• Theoretical studies of electron transfer and electron localization at the semiconductor-liquid interface 1997
• A Personal Note 1997
• Gerischer, Heinz-March 31, 1919 September 14, 1994 1997
• Gerischer, Heinz-March 31, 1919 September 14, 1994-Biography 1997