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42
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Photoionization Efficiency Spectrum and Ionization Energy of OBrO
Structures, Energetics, and Transition States of the Silicon−Phosphorus Compounds Si2PHn(n = 7, 5, 3, 1). An ab Initio Molecular Orbital Study
Flow Tube Studies of Benzene Charge Transfer Reactions from 250 to 1400 K
Free Energy Gap Dependence of the Electron-Transfer Rate from the Inverted to theNormal Region
Site Specific Rotational Mobility of Anhydrous Glucose near the Glass Transition AsStudied by 2D Echo Decay 13C NMR
Ultrafast Dynamics in the Metal-to-Ligand Charge Transfer Excited-State Evolution of[Ru(4,4‘-diphenyl-2,2‘-bipyridine)3]2+
Cubic Optical Response of Molecules in a Nonequilibrium and Equilibrium Solvation Model
Generation and Kinetic Studies of Xe(5d[3/2]1) Resonance State Atoms
Classical and Inverted Structures of SiXnH3-nLi and SiXnH3-nNa
Ionization Potentials of Seaborgium
Solution Electron Affinity Perturbation Due to the Deuteration of [16]Annulene
Ab Initio and Density Functional Studies of Substituent Effects of an A−U Base Pair on theStability of Hydrogen Bonding
Refractive Indices of Molecules in Vapor and Liquid: Calculations on Benzene
Nature and Dynamics of Lithium Ion Coordination in Oligo(ethylene glycol)Dimethacrylate-Solvent Systems: NMR, Raman, and Quantum Mechanical Study
Theoretical Calculation of the Interaction of Hydrogen with Models of CoordinativelyUnsaturated Centers on Alumina
Preferential Solvation of Li+ in 18.45 Aqueous Ammonia: A Born−Oppenheimerab Initio Quantum Mechanics/Molecular Mechanics MD Simulation
Structure and Energetics of the Weakly Bound NH3···H2O Complex
Energy Relaxation Dynamics of Photofragments Measured by Probe Beam DeflectionTechnique: Photodissociation of CF3I at 266 nm
Pressure Effect on CH3 and C2H3 Cross-Radical Reactions
Van der Waals Complexes of Tropolone with Carbon Dioxide
Theoretical Estimates of Redox Potentials for Group 6 Elements, Including Element 106,Seaborgium, in Acid Solutions
Kinetic Energy Release Distributions in the Dissociation of Energy-Selected Fluoroetheneand 1,1-Difluoroethene Ions
Radiation-Induced and Photosensitized Splitting of C5−C5‘-Linked DihydrothymineDimers: Product and Laser Flash Photolysis Studies on the Oxidative Splitting Mechanism
Triplet Characterization and Dynamics of a Novel Pyrene Derivative Covalently Linked toAzurin
Ab Initio Topological Analysis of the Electronic Density in Isobutonium Cations
193 nm Photodissociation of Thiophene Probed Using Synchrotron Radiation
A Transition in the Ni2+ Complex Structure from Six- to Four-Coordinate upon Formationof Ion Pair Species in Supercritical Water: An X-ray Absorption Fine Structure,Near-Infrared, and Molecular Dynamics Study
On the Mechanism of the BrO + CH2O Reaction
A Quantum Chemical Study of the C−C Bond Fission Pathways of Alkoxy RadicalsFormed following OH Addition to Isoprene
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