Skip Nav Destination
Issues
1 October 1971
ISSN 0021-9606
EISSN 1089-7690
In this Issue
Investigation of Energy‐Transfer Mechanisms in Pyrene Crystals
J. Chem. Phys. 55, 3059–3067 (1971)
https://doi.org/10.1063/1.1676546
Dielectric Studies. XXX. Complex Formation and Intramolecular Hydrogen Bond Fission in ortho‐Substituted Phenols
J. Chem. Phys. 55, 3068–3071 (1971)
https://doi.org/10.1063/1.1676547
Nuclear Magnetic Relaxation in t‐Butanol: Molecular and Internal Methyl Rotation
J. Chem. Phys. 55, 3072–3078 (1971)
https://doi.org/10.1063/1.1676548
Survival Probability of Products of Hot Reactions of (n, γ)‐Produced 38Cl with CH3Cl in the Gas Phase
J. Chem. Phys. 55, 3094–3100 (1971)
https://doi.org/10.1063/1.1676551
Microwave Spectrum, Ring‐Puckering Potential Function, and Dipole Moment of 3,3‐Difluoroxetane
J. Chem. Phys. 55, 3105–3110 (1971)
https://doi.org/10.1063/1.1676553
Microwave Spectrum, Barrier to Internal Rotation, and Dipole Moment of cis‐3‐Pentene‐1‐yne
J. Chem. Phys. 55, 3110–3113 (1971)
https://doi.org/10.1063/1.1676554
Gas‐Phase Recombination of Hydrogen. A Comparison between Theory and Experiment
J. Chem. Phys. 55, 3126–3132 (1971)
https://doi.org/10.1063/1.1676558
Classical S Matrix for Linear Reactive Collisions of
J. Chem. Phys. 55, 3150–3156 (1971)
https://doi.org/10.1063/1.1676561
Dissociative Excitation of O2 in the Vacuum Ultraviolet by Electron Impact
J. Chem. Phys. 55, 3156–3157 (1971)
https://doi.org/10.1063/1.1676562
Emission Cross Sections of CO by Electron Impact in the Interval 1260–5000 Å. I
J. Chem. Phys. 55, 3158–3168 (1971)
https://doi.org/10.1063/1.1676563
Emission Cross Sections of CO2 by Electron Impact in the Interval 1260–4500 Å. II
J. Chem. Phys. 55, 3169–3177 (1971)
https://doi.org/10.1063/1.1676564
Rutile: Normal Probability Plot Analysis and Accurate Measurement of Crystal Structure
J. Chem. Phys. 55, 3206–3211 (1971)
https://doi.org/10.1063/1.1676569
Scattering of Helium Atoms by Phonons in the (001) Surface of LiF at 150°K
J. Chem. Phys. 55, 3220–3236 (1971)
https://doi.org/10.1063/1.1676571
Interaction of Oxygen with Polycrystalline Tungsten. I. Sticking Probabilities and Desorption Spectra
J. Chem. Phys. 55, 3236–3246 (1971)
https://doi.org/10.1063/1.1676572
Interaction of Oxygen with Polycrystalline Tungsten. II. Corrosive Oxidation
J. Chem. Phys. 55, 3247–3253 (1971)
https://doi.org/10.1063/1.1676573
Analysis of the D and 17O Quadrupole Coupling Constants in Ice Ih
J. Chem. Phys. 55, 3253–3259 (1971)
https://doi.org/10.1063/1.1676574
Cation Motion in Anionic Fields of the Polyelectrolytic Salts of Ethylenemethacrylic Copolymers
J. Chem. Phys. 55, 3260–3269 (1971)
https://doi.org/10.1063/1.1676575
Transport Properties of a Gas of Diatomic Molecules. III. RDW Approximation to the Rotational Relaxation Time
J. Chem. Phys. 55, 3276–3283 (1971)
https://doi.org/10.1063/1.1676577
Temperature‐Dependent Raman Study and Molecular Motion in l‐Alanine Single Crystal
J. Chem. Phys. 55, 3291–3299 (1971)
https://doi.org/10.1063/1.1676579
Raman Scattering Studies in Liquids and Glasses. II. Liquid and Supercooled Liquid Glycerol
J. Chem. Phys. 55, 3300–3307 (1971)
https://doi.org/10.1063/1.1676580
Proton Magnetic Resonance and Relaxation in
J. Chem. Phys. 55, 3307–3310 (1971)
https://doi.org/10.1063/1.1676581
Calculation of the Anharmonicity in the Vibrational Frequencies of Alkane Molecules by the CFF Functions
J. Chem. Phys. 55, 3327–3335 (1971)
https://doi.org/10.1063/1.1676584
Excited State Chemistry of the Ferrocyanide Ion in Aqueous Solution. I. Formation of the Hydrated Electron
J. Chem. Phys. 55, 3372–3378 (1971)
https://doi.org/10.1063/1.1676587
Excited State Chemistry of the Ferrocyanide Ion in Aqueous Solution. II. Photoaquation
J. Chem. Phys. 55, 3379–3382 (1971)
https://doi.org/10.1063/1.1676588
ESR Study of a Carboxyl Radical Trapped in a Single Crystal of Maleic Acid Irradiated at 77°K
J. Chem. Phys. 55, 3442–3449 (1971)
https://doi.org/10.1063/1.1676597
Effect of Pressure on the Electronic Structure of Complexes of Ferrous Iron with Substituted Phenanthrolines
J. Chem. Phys. 55, 3471–3482 (1971)
https://doi.org/10.1063/1.1676601
Contribution to the Theory of Frenkel Excitons in Disordered Molecular Crystals
J. Chem. Phys. 55, 3491–3499 (1971)
https://doi.org/10.1063/1.1676603
Kinetic Energies of Ionization Products from Collisions of below 150 eV c.m. Energy
J. Chem. Phys. 55, 3506–3515 (1971)
https://doi.org/10.1063/1.1676605
Studies of OH− and OD− Ions in Magnesium Oxide. II. The Structure of the VOD Center
J. Chem. Phys. 55, 3519–3524 (1971)
https://doi.org/10.1063/1.1676607
Some Superconducting Intercalation Complexes of TaS2 and Substituted Pyridines
J. Chem. Phys. 55, 3525–3530 (1971)
https://doi.org/10.1063/1.1676608
Interpretation of Rate Constants Measured in Drift Tubes in Terms of Cross Sections
J. Chem. Phys. 55, 3531–3541 (1971)
https://doi.org/10.1063/1.1676609
Molecular Multipole Moments Determined from Viscosity and Second Virial Coefficients
J. Chem. Phys. 55, 3541–3545 (1971)
https://doi.org/10.1063/1.1676610
Dissociation of Cyclobutane Molecule—Ions Formed in Charge Exchange Collisions
J. Chem. Phys. 55, 3555–3561 (1971)
https://doi.org/10.1063/1.1676612
Dissociation of CO2 by Electron Impact with the Formation of Metastable CO(a 3Π) and O(5S)
J. Chem. Phys. 55, 3569–3577 (1971)
https://doi.org/10.1063/1.1676615
Molecular Motions in CCl4: Light Scattering and Infrared Absorption
J. Chem. Phys. 55, 3585–3588 (1971)
https://doi.org/10.1063/1.1676617
Search for a Trapped Hole in an Irradiated Crystal of L‐Alanine by the ESR Technique
J. Chem. Phys. 55, 3589–3594 (1971)
https://doi.org/10.1063/1.1676619
LETTERS TO THE EDITOR
COMMUNICATIONS
NOTES
Investigation of the High Temperature Phase Transition in RbH2PO4 by Scattering of Cold Neutrons
J. Chem. Phys. 55, 3599–3601 (1971)
https://doi.org/10.1063/1.1676623
Ionization Measurements in Mercury Vapor with Beta Particles and the Mean Energy to Form an Ion Pair
J. Chem. Phys. 55, 3603–3604 (1971)
https://doi.org/10.1063/1.1676625
Spin‐Lattice Relaxation Measurements in Slowly Relaxing Complex Spectra
J. Chem. Phys. 55, 3604–3605 (1971)
https://doi.org/10.1063/1.1676626
Toward a Unified Interpretation of ESR Trapped‐Hole Centers in Irradiated Borate Compounds and Glasses
J. Chem. Phys. 55, 3610–3611 (1971)
https://doi.org/10.1063/1.1676630
COMMENTS
ERRATA
DeePMD-kit v2: A software package for deep potential models
Jinzhe Zeng, Duo Zhang, et al.
CREST—A program for the exploration of low-energy molecular chemical space
Philipp Pracht, Stefan Grimme, et al.
Evaluation of the MACE force field architecture: From medicinal chemistry to materials science
Dávid Péter Kovács, Ilyes Batatia, et al.