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The Journal of Physical Chemistry A :

. Atom-Based Thermochemistry: Predictions of the Sublimation Enthalpies of Group 12 Chalcogenides and the Formation Enthalpies of their Polonides
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Photodissociation Dynamics of 2-Nitropropane and 2-Methyl-2-nitropropane at 248 and 193 nm
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Experimental and Theoretical Study of the Atmospheric Chemistry and Global Warming Potential of SO2F2
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Comparison Studies of the Human Heart and Bacillus stearothermophilus Lactate Dehydrogreanse by Transition Path Sampling†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Intrinsic Gas-Phase Reactivity toward Methanol of Trinuclear Tungsten W3S4 Complexes Bearing W−X (X = Br, OH) Groups
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Low-Frequency Phonon Modes and Negative Thermal Expansion in A(MO4)2 (A = Zr, Hf and M = W, Mo) by Raman and Terahertz Time-Domain Spectroscopy
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Quantum Mechanical Capture/Phase Space Theory Calculation of the Rate Constants for the Complex-Forming CH + H2 Reaction
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. On the Extent and Connectivity of Conical Intersection Seams and the Effects of Three-State Intersections
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Effect of Surfactant-Perturbed Nanocaging on the Ground and Excited State Proton Transfer Reaction
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Spectroscopically Determined Force Field for Water Dimer: Physically Enhanced Treatment of Hydrogen Bonding in Molecular Mechanics Energy Functions
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Quasi-Free Methyl Rotation in Zeolitic Imidazolate Framework-8
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Superoxide Radical Anion Adduct of 5,5-Dimethyl-1-pyrroline N-Oxide. 4. Conformational Effects on the EPR Hyperfine Splitting Constants
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Electronic Structure, Molecular Electrostatic Potential, and NMR Chemical Shifts in Cucurbit[n]urils (n = 5−8), Ferrocene, and Their Complexes
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Photoelectron Angular Distribution and Molecular Structure in Multiply Charged Anions
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. A Theoretical Study of the Cyclization Processes of Energized CCCSi and CCCP
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. An Investigation of the Rotamers of Butadiene by High-Resolution Infrared Spectroscopy
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Gas-Phase Reactions of Doubly Charged Lanthanide Cations with Alkanes and Alkenes. Trends in Metal(2+) Reactivity
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. 35Cl Solid-State NMR of Halide Ionic Liquids at Ultrahigh Fields
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Energies of Low-Lying Excited States of Linear Polyenes
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Aromaticity and Antiaromaticity in the Low-Lying Electronic States of Cyclooctatetraene
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Dimers of Fluorinated Methanes with Carbonyl Sulfide: The Rotational Spectrum and Structure of Difluoromethane−OCS
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Ion Partitioning at the Liquid/Vapor Interface of a Multicomponent Alkali Halide Solution: A Model for Aqueous Sea Salt Aerosols
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Coordination Properties of Lysine Interacting with Co(I) and Co(II). A Theoretical and Mass Spectrometry Study
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Range Separation and Local Hybridization in Density Functional Theory†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Density Functional Theory Study of CsCn− (n = 1−10) Clusters
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Performance of Block Correlated Coupled Cluster Method with the CASSCF Reference Function for the Prediction of Activation Barriers, Spectroscopic Constants in Diatomic Molecules, and Singlet−Triplet Gaps in Diradicals
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Infrared Spectrum of the CH3−PtH Complex in Solid Argon Prepared in the Oxidative C−H Insertion of Methane by Laser-Ablated Pt Atoms
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Reactivity of Superoxide Radical Anion and Hydroperoxyl Radical with α-Phenyl-N-tert-butylnitrone (PBN) Derivatives
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. On the Importance of Electron Correlation Effects for the Intramolecular Stacking Geometry of a Bis-Thiophene Derivative
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Microsolvation of Protonated Methane: Structures and Energetics of CH5+(H2)n
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Tautomerism of Uracil Probed via Infrared Spectroscopy of Singly Hydrated Protonated Uracil
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Vibronically Resolved Electronic Circular Dichroism Spectra of (R)-(+)-3-Methylcyclopentanone: A Theoretical Study
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Ultraviolet Photolysis of HCHO: Absolute HCO Quantum Yields by Direct Detection of the HCO Radical Photoproduct
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Ab Initio Studies of Properties of Small Potassium Clusters
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Time Evolution of the Activation Energy in a Batch Chemical Oscillator
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Synthesis, Molecular Structure, and EPR Analysis of the Three-Coordinate Ni(I) Complex [Ni(PPh3)3][BF4]
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Structure and Electric Properties of SnN Clusters (N = 6−20) from Combined Electric Deflection Experiments and Quantum Theoretical Studies
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. First-Principles Study of Electronic and Magnetic Properties of ConMnm and ConVm (m + n ≤ 6) Clusters
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. One-Electron Metal−Metal Bond Stabilized in Dinuclear Metallocenes: Theoretical Prediction of DBe-LiCp (D = C5H5 or C5Me5)
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Combined Experimental and Theoretical Approach To Understand the Reactivity of a Mononuclear Cu(II)−Hydroperoxo Complex in Oxygenation Reactions†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Complexation of Lead(II) by Chlorogenic Acid: Experimental and Theoretical Study
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Vibrationally Induced Proton Transfer in F−(H2O) and F−(D2O)
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Computational Study of the Reaction of CH2(X3B1) with CH3OH
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Photodissociation of Noble Metal-Doped Carbon Clusters
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. The Nature of Resonance in Allyl Ions and Radical†
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Multiple Transmission−Reflection Infrared Spectroscopy for High-Sensitivity Measurement of Molecular Monolayers on Silicon Surfaces
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Reactions of Hydrated Electrons with Pyridinium Salts in Aqueous Solutions
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Experimental and Theoretical Study of the Carbon-13 and Deuterium Kinetic Isotope Effects in the Cl and OH Reactions of CH3F
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Toward a Consistent Treatment of Polarization in Model QM/MM Calculations
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).

. Assessing the Role of Polarization in Docking
The Journal of Physical Chemistry A, Volume 0, Issue 0, Articles ASAP (As Soon As Publishable).