J. Phys. Chem. A
latest articles published in The Journal of Physical Chemistry A
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Unique Stoichiometric Representation for Computational Thermochemistry
Categories: American Chemical Society
Improvement of the Modeling of the Low-Temperature Oxidation of n-Butane: Study of the Primary Reactions
Categories: American Chemical Society
Jahn–Teller Intersections Induced by Introduction of Bending in Linear Polyatomics: Study with HCNH, a Selected Molecular System
Categories: American Chemical Society
The Overall Reaction Process of Ozone with Methacrolein and Isoprene in the Condensed Phase
Categories: American Chemical Society
Effects of Charge Location on the Absorptions and Lifetimes of Protonated Tyrosine Peptides in Vacuo
Categories: American Chemical Society
Density Functional Theory Study of Semiquinone Radical Anions of Polychlorinated Biphenyls in the Syn- and Anti-like Conformation
Categories: American Chemical Society
High H2 Uptake in Li-, Na-, K-Metalated Covalent Organic Frameworks and Metal Organic Frameworks at 298 K
Categories: American Chemical Society
Theoretical Studies of the Excited Doublet States of SF and SCl and Singlet States of SF2, SFCl, and SCl2
Categories: American Chemical Society
Nanostructured Diamine–Fullerene Derivatives: Computational Density Functional Theory Study and Experimental Evidence for their Formation via Gas-Phase Functionalization
Categories: American Chemical Society
ATR-FTIR Studies on the Adsorption/Desorption Kinetics of Dimethylarsinic Acid on Iron–(Oxyhydr)oxides
Categories: American Chemical Society
High Resolution Millimeter-Wave Spectroscopy of Cyclopropylphosphine–Borane
Categories: American Chemical Society
Nonadiabatic Decay Dynamics of a Benzylidene Malononitrile
Categories: American Chemical Society
Organic Peracids: A Structural Puzzle for 17O NMR and Ab Initio Chemical Shift Calculations
Categories: American Chemical Society
Decomposition of Aminotetrazole Based Energetic Materials under High Heating Rate Conditions
Categories: American Chemical Society
Infrared Multiple Photon Dissociation Spectroscopy of Cationized Histidine: Effects of Metal Cation Size on Gas-Phase Conformation
Categories: American Chemical Society
Micro-Raman Observation on the HPO42– Association Structures in an Individual Dipotassium Hydrogen Phosphate (K2HPO4) Droplet
Categories: American Chemical Society
Relative Rate Study of the Kinetics, Mechanism, and Thermodynamics of the Reaction of Chlorine Atoms with CF3CFCH2 (HFO-1234yf) in 650–950 Torr of N2 or N2/O2Diluent at 296–462 K
Categories: American Chemical Society
High-Resolution Absorption Cross Sections of Formaldehyde in the 30285–32890 cm–1 (304–330 nm) Spectral Region
Categories: American Chemical Society
From Vanadium Naphthalene (Vn–1Npn) Sandwich Clusters to VNp Sandwich Nanowire: Structural, Energetic, Electronic, and Magnetic Properties
Categories: American Chemical Society
Carbon Dioxide in 1-Butyl-3-methylimidazolium Acetate. I. Unusual Solubility Investigated by Raman Spectroscopy and DFT Calculations
Categories: American Chemical Society