Hide Menu
Hide Menu   Home   |     About Us   |   Contact   |   Imprint   |   Privacy   |   Sitemap
Hide Menu   Chemistry Index   |   Chemicals   |   Chemical Elements
Hide Menu   Lab Instruments   |  
Hide Menu   Job Vacancies   |  
Hide Menu   Chemistry Forum   |  
Chemistry A - Z
Equipment for Lab and Industry
Chemicals and Compounds
Job Vacancies
Imprint, Contact

 

Journal of Physical Chemistry A

Current research reports and chronological list of recent articles..




Part A: Dynamics, Kinetics, Environmental Chemistry, Spectroscopy, Structure, Theory. The international scientific Journal of Physical Chemistry A publishes studies on dynamics, clusters, and excited states; kinetics, and spectroscopy; atmospheric, environmental, and green chemistry; and molecular structure, quantum chemistry, and general theory.

The publisher is the American Chemical Society, ACS. The copyright and publishing rights of specialized products listed below are in this publishing house. This is also responsible for the content shown.

To search this web page for specific words type "Ctrl" + "F" on your keyboard (Command + "F" on a Mac). Then: type the word you are searching for in the window that pops up!

Additional research articles see Current Chemistry Research Articles. Magazines with similar content (physical chemistry):

 - ChemPhysChem.

 - Doklady Physical Chemistry.

 - Faraday Discussions.

 - International Reviews in Physical Chemistry.

 - Journal of Physical Chemistry B.

 - Journal of Physical Chemistry C.

 - Journal of Physical Organic Chemistry.

 - Physical Chemistry Chemical Physics PCCP.

 - Russian Journal of Physical Chemistry A.

 - Russian Journal of Physical Chemistry B.



Journal of Physical Chemistry A - Abstracts



[ASAP] Simulation of Low-Lying Singlet and Triplet Excited States of Multiple-Resonance-Type Thermally Activated Delayed Fluorescence Emitters by Delta Self-Consistent Field (ΔSCF) Method

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08900

Datum: 01.12.2021


[ASAP] F12-TZ-cCR: A Methodology for Faster and Still Highly Accurate Quartic Force Fields

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08355

Datum: 30.11.2021


[ASAP] Higher-Energy Hexafluoroisopropanol···Water Isomer and Its Large Amplitude Motions: Rotational Spectra and DFT Calculations

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c09058

Datum: 30.11.2021


[ASAP] Theoretical Investigation of the Excited-State Dynamics Mechanism of the Asymmetric Two-Way Proton Transfer Molecule BTHMB

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c05530

Datum: 30.11.2021


[ASAP] Cyclotrimerization of Acetylene on Clusters Co<sub><italic toggle="yes">n</italic></sub><sup>+</sup>/Fe<sub><italic toggle="yes">n</italic></sub><sup>+</sup>/Ni<sub><italic toggle="yes">n</italic></sub><sup>+</sup>(<italic toggle="yes">n</italic> = 1–16)

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c09015

Datum: 30.11.2021


[ASAP] On the Ability of Nitrogen to Serve as an Electron Acceptor in a Pnicogen Bond

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c09213

Datum: 30.11.2021


[ASAP] Chemistry of Functionalized Reactive Organic Intermediates in the Earth’s Atmosphere: Impact, Challenges, and Progress

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08221

Datum: 30.11.2021


[ASAP] Topological Ring Currents and Bond Currents in Neutral and Dianionic <italic toggle="yes">Altans</italic> and Iterated <italic toggle="yes">Altans</italic> of Benzene, Naphthalene, and Azulene

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07846

Datum: 29.11.2021


[ASAP] Chemistry of Simple Organic Peroxy Radicals under Atmospheric through Combustion Conditions: Role of Temperature, Pressure, and NO<sub><italic toggle="yes">x</italic></sub> Level

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07203

Datum: 29.11.2021


[ASAP] Comparative Quantum Chemistry Study on the Unimolecular Decomposition Channels of Pyrazole and Imidazole Energetic Materials

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08274

Datum: 29.11.2021


[ASAP] Relativistic Four-Component DFT Calculations of Vibrational Frequencies

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07398

Datum: 29.11.2021


[ASAP] Enhancing the Accuracy of Ab Initio Molecular Dynamics by Fine Tuning of Effective Two-Body Interactions: Acetonitrile as a Test Case

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07576

Datum: 29.11.2021


[ASAP] Is Dissociation of HCl in DMSO Clusters Bistable?

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08627

Datum: 25.11.2021


[ASAP] Theoretical Aspects of Nonconventional Hydrogen Bonds in the Complexes of Aldehydes and Hydrogen Chalcogenides

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c06708

Datum: 24.11.2021


[ASAP] Classical Electrostatics Remains the Driving Force for Interanion Hydrogen and Halogen Bonding

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c09250

Datum: 24.11.2021


[ASAP] Conformation of Benzo-12-Crown-4 Complexes with Ammonium Ions Investigated by Cold Gas-Phase Spectroscopy

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c09091

Datum: 24.11.2021


[ASAP] OH Kinetics with a Range of Nitrogen-Containing Compounds: <italic toggle="yes">N</italic>-Methylformamide, <italic toggle="yes">t</italic>-Butylamine, and <italic toggle="yes">N</italic>-Methyl-propane Diamine

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08104

Datum: 24.11.2021


[ASAP] Simple and Versatile Scheme for the Stereochemical Identification of Natural Products and Diverse Organic Compounds with Multiple Asymmetric Centers

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08687

Datum: 24.11.2021


[ASAP] Predictive Combustion Kinetics of OH Radical Reactions with a C5 Unsaturated Alcohol: The Competitive H-Abstraction and OH-Addition Reactions of 2-Methyl-3-buten-2-ol

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07623

Datum: 23.11.2021


[ASAP] Substituent Effects on Aluminyl Anions and Derived Systems: A High-Level Theory

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08918

Datum: 23.11.2021


[ASAP] Analytic Alchemical Derivatives for the Analysis of Differential Acidity Assisted by the <italic toggle="yes">h</italic> Function

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07364

Datum: 23.11.2021


[ASAP] Small Matrix Path Integral for Driven Dissipative Dynamics

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08230

Datum: 23.11.2021


[ASAP] Photodissociation Dynamics of Methyl Hydroperoxide at 193 nm: A Trajectory Surface-Hopping Study

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07785

Datum: 22.11.2021


[ASAP] Investigation of the Structural and Thermochemical Properties of [2.2.2]-Bicyclooctadiene Photoswitches

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07737

Datum: 22.11.2021


[ASAP] Determining Dielectric Constants for Complex Solvent Mixtures by Microwave Sensing and Model Prediction

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07404

Datum: 19.11.2021


[ASAP] Prediction of Phase State of Secondary Organic Aerosol Internally Mixed with Aqueous Inorganic Salts

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c06773

Datum: 19.11.2021


[ASAP] Disorder in P3HT Nanoparticles Probed by Optical Spectroscopy on P3HT-<italic toggle="yes">b</italic>-PEG Micelles

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08377

Datum: 19.11.2021


[ASAP] Theoretical Studies on Bimetallic Salen Complexes Catalyzed Epoxide Hydration: Effects of Metal Centers, Substrates, and Ligands

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07707

Datum: 18.11.2021


[ASAP] Gas- and Particle-Phase Products and Their Mechanisms of Formation from the Reaction of Δ-3-Carene with NO<sub>3</sub> Radicals

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07763

Datum: 18.11.2021


[ASAP] Computational Study of Photochemical Relaxation Pathways of Platinum(II) Complexes

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07017

Datum: 18.11.2021


[ASAP] A Mountaineering Strategy to Excited States: Highly Accurate Energies and Benchmarks for Bicyclic Systems

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08524

Datum: 18.11.2021


[ASAP] Sub-picosecond Production of Solute Radical Cations in Tetrahydrofuran after Radiolysis

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08568

Datum: 18.11.2021


[ASAP] Statistical Analysis on Rate Parameters of the H<sub>2</sub>–O<sub>2</sub> Reaction System

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c08250

Datum: 17.11.2021


[ASAP] XUV-Initiated Dissociation Dynamics of Molecular Oxygen (O<sub>2</sub>)

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c06033

Datum: 17.11.2021


[ASAP] Time-Domain Vibrational Action Spectroscopy of Cryogenically Cooled, Messenger-Tagged Ions Using Ultrafast IR Pulses

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c01996

Datum: 17.11.2021


[ASAP] Computational Studies of Uranium Hexafluoride Interacting with Functionalized Organics. I. Screening Intermolecular Potentials between UF<sub>6</sub> and Small Organic Functional Groups

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c05853

Datum: 10.11.2021


[ASAP] XNgNSi (X = HCC, F; Ng = Kr, Xe, Rn): A New Class of Metastable Insertion Compounds Containing Ng–C/F and Ng–N Bonds and Possible Isomerization therein

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07677

Datum: 08.11.2021


[ASAP] Which Way Does Stimulated Emission Go?

TOC Graphic

The Journal of Physical Chemistry A
DOI: 10.1021/acs.jpca.1c07713

Datum: 03.11.2021


 


Category: Current Chemistry Research

Last update: 28.03.2018.






© 1996 - 2020 Internetchemistry














I agree!

This site uses cookies. By using this website, you agree to the use of cookies! Learn more ...