Skip Nav Destination
Issues
15 April 1972
ISSN 0021-9606
EISSN 1089-7690
In this Issue
Lattice Vibrations, Crystal Structure, Dielectric Properties, and Elastic Constants of AgF
J. Chem. Phys. 56, 3735–3739 (1972)
https://doi.org/10.1063/1.1677770
Model Calculations of Transport Coefficients for a Gas of Tetrahedral Molecules in a Magnetic Field
J. Chem. Phys. 56, 3740–3749 (1972)
https://doi.org/10.1063/1.1677771
Low‐Temperature Magnetic Characteristics of Tetrahedral Tensor Orientation in Doped [(C2H5)4N]2ZnCl4
J. Chem. Phys. 56, 3750–3754 (1972)
https://doi.org/10.1063/1.1677772
Low‐Temperature Magnetic Characteristics of Tetrahedral . II. Nature of the Phase Transition in [(C2H5)4N]2CoCl4
J. Chem. Phys. 56, 3755–3758 (1972)
https://doi.org/10.1063/1.1677773
Angular Dependence of Electron Impact Excitation Cross Sections of O2
J. Chem. Phys. 56, 3759–3765 (1972)
https://doi.org/10.1063/1.1677774
Application of the Eikonal Approximation to Electron Scattering. II. Inelastic Scattering from Helium
J. Chem. Phys. 56, 3769–3772 (1972)
https://doi.org/10.1063/1.1677776
Quantum Mechanical Perturbation Expansion for the Second Virial Coefficient and the Ursell‐Mayer Function
J. Chem. Phys. 56, 3773–3782 (1972)
https://doi.org/10.1063/1.1677777
Determination of Thermal Transport Properties from Thermal Transpiration Measurements. II
J. Chem. Phys. 56, 3789–3793 (1972)
https://doi.org/10.1063/1.1677780
Molecular Structures of Perfluoromethyl Iodide, Perfluoroethyl Iodide, and Perfluoroisopropyl Iodide
J. Chem. Phys. 56, 3802–3811 (1972)
https://doi.org/10.1063/1.1677783
Roles of Repulsive and Attractive Forces in Liquids: The Optimized Random Phase Approximation
J. Chem. Phys. 56, 3812–3823 (1972)
https://doi.org/10.1063/1.1677784
Exact Solutions to the Coupled Hartree‐Fock Perturbation Equations
J. Chem. Phys. 56, 3823–3831 (1972)
https://doi.org/10.1063/1.1677785
Infrared Absorptions of Interstitial Hydrogen Atoms in Solid Argon and Krypton
J. Chem. Phys. 56, 3832–3836 (1972)
https://doi.org/10.1063/1.1677786
Microwave Spectrum, Structure, and Dipole Moment of Bicyclo[2.1.0]pentane
J. Chem. Phys. 56, 3837–3842 (1972)
https://doi.org/10.1063/1.1677787
Quantum‐Mechanical Hamiltonian for Chemical Reactions. II. Practical Considerations
J. Chem. Phys. 56, 3843–3849 (1972)
https://doi.org/10.1063/1.1677788
Calculation of the Spin‐Spin and Spin‐Orbit Contribution to the Zero‐Field Splitting in Hemin
J. Chem. Phys. 56, 3861–3873 (1972)
https://doi.org/10.1063/1.1677791
Quantum Calculations of Planar Reactive . Theory
J. Chem. Phys. 56, 3874–3884 (1972)
https://doi.org/10.1063/1.1677792
Quantum Calculations of Planar Reactive . II. Application
J. Chem. Phys. 56, 3885–3897 (1972)
https://doi.org/10.1063/1.1677793
Proton, Deuteron, and Nitrogen Resonance of Dimethylformamide in Nematic Polypeptide Liquid Crystals
J. Chem. Phys. 56, 3920–3928 (1972)
https://doi.org/10.1063/1.1677796
Quantum Yield for Unimolecular Dissociation of I2 in Visible Absorption
J. Chem. Phys. 56, 3929–3938 (1972)
https://doi.org/10.1063/1.1677797
Role of Electron Correlation in a Priori Predictions of the Electronic Ground State of BeO
J. Chem. Phys. 56, 3938–3942 (1972)
https://doi.org/10.1063/1.1677798
Influence of an External Electric Field on the Charge Transfer State of the TCNE‐trans‐Stilbene Molecular Complex
J. Chem. Phys. 56, 3947–3951 (1972)
https://doi.org/10.1063/1.1677800
Formaldehyde: Comprehensive Spectral Investigation as a Function of Solvent and Temperature
J. Chem. Phys. 56, 3956–3963 (1972)
https://doi.org/10.1063/1.1677802
Electric Deflection of Molecular Beams of Carbon Suboxide and Carbon Subsulfide
J. Chem. Phys. 56, 3993–3995 (1972)
https://doi.org/10.1063/1.1677806
Electrocapillary Studies on Partially Immersed Mercury‐Plated Electrode in DMF‐Water Solutions
J. Chem. Phys. 56, 3996–4000 (1972)
https://doi.org/10.1063/1.1677807
Excitation with Monochromatic Light of a Vibronically Broadened Molecular Band
J. Chem. Phys. 56, 4011–4019 (1972)
https://doi.org/10.1063/1.1677809
Theory of Radiationless Relaxation of Rare‐Earth Ions in Crystals
J. Chem. Phys. 56, 4020–4027 (1972)
https://doi.org/10.1063/1.1677810
Higher Derivatives in the Thermodynamics of Nonuniform Solutions. I. Basic Interface Theory
J. Chem. Phys. 56, 4043–4053 (1972)
https://doi.org/10.1063/1.1677814
Zero‐Field Splitting of the Triplet State in Zinc Etioporphyrin
J. Chem. Phys. 56, 4073–4078 (1972)
https://doi.org/10.1063/1.1677817
Application of Diffusion Model for Recombination of Isolated Pairs in Condensed Media
J. Chem. Phys. 56, 4079–4085 (1972)
https://doi.org/10.1063/1.1677818
ESR Study of Heisenberg Spin Exchange in a Binary Liquid Solution near the Critical Point
J. Chem. Phys. 56, 4103–4114 (1972)
https://doi.org/10.1063/1.1677822
Cluster Expansion Method for the Density of Excited Electronic States of Substitutionally Disordered Crystals
J. Chem. Phys. 56, 4138–4146 (1972)
https://doi.org/10.1063/1.1677826
NMR Studies of a Series of Phenyl Substituted Ferric N‐Ethyl‐N‐Phenyldithiocarbamates
J. Chem. Phys. 56, 4147–4154 (1972)
https://doi.org/10.1063/1.1677827
Formation and Collisional Dissociation of Heteronuclear Rare‐Gas Associative Ions
J. Chem. Phys. 56, 4166–4170 (1972)
https://doi.org/10.1063/1.1677829
Infrared Spectrum of AlCl3 and Al2Cl6 Isolated in Solid Argon
J. Chem. Phys. 56, 4171–4177 (1972)
https://doi.org/10.1063/1.1677830
NMR Study of ThAl2: 27Al, Dipolar Doublet, Quadrupole, and Anisotropic Shift Interactions
J. Chem. Phys. 56, 4178–4183 (1972)
https://doi.org/10.1063/1.1677831
Differential Measurements of Dissociative Charge Exchange, He++CO2
J. Chem. Phys. 56, 4223–4226 (1972)
https://doi.org/10.1063/1.1677839
LETTERS TO THE EDITOR
COMMUNICATIONS
Chemi‐ionization in Collisions of Uranium Atoms with Oxygen Atoms and Molecules
J. Chem. Phys. 56, 4227–4228 (1972)
https://doi.org/10.1063/1.1677840
NOTES
Nuclear Spin Relaxation in F2 and F2‐Rare Gas Mixtures
J. Chem. Phys. 56, 4229–4231 (1972)
https://doi.org/10.1063/1.1677842
Viscosity of Molten ZnCl2 and Supercritical Behavior in Its Binary Solutions
J. Chem. Phys. 56, 4231–4233 (1972)
https://doi.org/10.1063/1.1677843
Self‐Consistent Molecular Orbital Methods. XIII. An Extended Gaussian‐Type Basis for Boron
J. Chem. Phys. 56, 4233–4234 (1972)
https://doi.org/10.1063/1.1677844
Coexistence Curve of the Binary Liquid System Acetonitrile‐Carbon Disulfide
J. Chem. Phys. 56, 4235–4236 (1972)
https://doi.org/10.1063/1.1677846
Electron Spin Resonance Study of Trapped Electron in 2‐Methyltetrahydrofuran Irradiated at 4°K
J. Chem. Phys. 56, 4238–4239 (1972)
https://doi.org/10.1063/1.1677848
Gaseous Phosphorus Compounds. VII. The Dissociation Energy and Heat of Formation of Boron Monophosphide
J. Chem. Phys. 56, 4239–4240 (1972)
https://doi.org/10.1063/1.1677849
Hydrogen‐Xenon Potential Energy Function Determined from High Energy Elastic Scattering
J. Chem. Phys. 56, 4241–4242 (1972)
https://doi.org/10.1063/1.1677850
COMMENTS
Comment on the Paper ``Oxygen Monofluoride (OF, 2π): Hartree‐Fock Wavefunction, Binding Energy, Ionization Potential, Electron Affinity, Dipole and Quadrupole Moments, and Spectroscopic Constants. A Comparison of Theoretical and Experimental Results'' by P. A. G. O'Hare and A. C. Wahl
J. Chem. Phys. 56, 4242–4243 (1972)
https://doi.org/10.1063/1.1677851
Comment on a Group‐Theoretical Method for Multicenter Integral Evaluation
J. Chem. Phys. 56, 4243–4244 (1972)
https://doi.org/10.1063/1.1677852
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.
Freezing point depression of salt aqueous solutions using the Madrid-2019 model
Cintia P. Lamas, Carlos Vega, et al.