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Issues
15 February 1968
ISSN 0021-9606
EISSN 1089-7690
In this Issue
Lattice Vibrations and Elastic Constants of Molecular Crystals in the Pair Potential Approximation
J. Chem. Phys. 48, 1438–1444 (1968)
https://doi.org/10.1063/1.1668859
Pyrolysis and Combustion of Metal Hydrides—Analysis by Kinetic Spectroscopy
J. Chem. Phys. 48, 1445–1451 (1968)
https://doi.org/10.1063/1.1668860
Absorption and Emission Spectra of OH and OD in Solid Ne. Evidence for Rotation
J. Chem. Phys. 48, 1459–1464 (1968)
https://doi.org/10.1063/1.1668863
Numerical Investigation of the Variational Principle Treatment of the Excluded Volume Problem
J. Chem. Phys. 48, 1488–1491 (1968)
https://doi.org/10.1063/1.1668867
Method of Diatomics‐in‐Molecules. VII. Excited Singlet States of H3+
J. Chem. Phys. 48, 1491–1496 (1968)
https://doi.org/10.1063/1.1668868
Double‐ζ LCAO SCF MO Calculations for NO2 and OF2
J. Chem. Phys. 48, 1497–1499 (1968)
https://doi.org/10.1063/1.1668869
SCF Minimal Basis Set Calculations and Exclusive Orbitals for CN−, HCN, N3−, HN3, NCO−, and HNCO
J. Chem. Phys. 48, 1500–1508 (1968)
https://doi.org/10.1063/1.1668870
Far‐Infrared Spectra of Ring Compounds. III. Spectrum, Structure, and Ring‐Puckering Potential of Silacyclobutane
J. Chem. Phys. 48, 1508–1513 (1968)
https://doi.org/10.1063/1.1668871
Transition in Cr3+:K3Co(CN)6 Crystals
J. Chem. Phys. 48, 1514–1517 (1968)
https://doi.org/10.1063/1.1668872
Ion‐Molecule and Chemi‐ionization Reactions in H2 by Photoionization
J. Chem. Phys. 48, 1518–1527 (1968)
https://doi.org/10.1063/1.1668873
Charge Transfer and Proton Transfer in Polyatomic Ion‐Molecule Systems
J. Chem. Phys. 48, 1559–1570 (1968)
https://doi.org/10.1063/1.1668878
Boron Trifluoride: The Analysis of and the Determination of the Molecular Geometry
J. Chem. Phys. 48, 1571–1579 (1968)
https://doi.org/10.1063/1.1668879
Valence‐Bond Theory for Simple Hydrocarbon Molecules, Radicals, and Ions
J. Chem. Phys. 48, 1579–1594 (1968)
https://doi.org/10.1063/1.1668880
Fluorescence Quenching Via Charge Transfer: The Perylene‐N,N‐Dimethylaniline System
J. Chem. Phys. 48, 1595–1601 (1968)
https://doi.org/10.1063/1.1668881
Abundance of Excited Ions in O+ and O2+ Ion Beams
J. Chem. Phys. 48, 1602–1608 (1968)
https://doi.org/10.1063/1.1668882
Nanosecond Pulse Radiolysis Studies of the Reaction of Ions in Cyclohexane Solutions
J. Chem. Phys. 48, 1608–1612 (1968)
https://doi.org/10.1063/1.1668883
Relative Interaction Radii for Quenching of Triplet‐State Molecules
J. Chem. Phys. 48, 1613–1619 (1968)
https://doi.org/10.1063/1.1668885
Microwave Spectrum, Conformation, Dipole Moment, and Barrier to Internal Rotation in Methyl Vinyl Ether
J. Chem. Phys. 48, 1620–1626 (1968)
https://doi.org/10.1063/1.1668886
Semiclassical Treatment of Multiple Turning‐Point Problems—Phase Shifts and Eigenvalues
J. Chem. Phys. 48, 1651–1658 (1968)
https://doi.org/10.1063/1.1668891
Low‐Temperature Viscosity Cross Sections Measured in a Supersonic Argon Beam
J. Chem. Phys. 48, 1674–1684 (1968)
https://doi.org/10.1063/1.1668894
Reconsideration of the Internal Tetramethylsilane Reference for Proton Magnetic Resonance Studies
J. Chem. Phys. 48, 1732–1735 (1968)
https://doi.org/10.1063/1.1668901
Polarization of Transitions to the Magnetic Substates of Triplet Excitons
J. Chem. Phys. 48, 1745–1748 (1968)
https://doi.org/10.1063/1.1668904
Magnetic Susceptibility of Thorium Carbides, Nitrides, and Carbonitrides
J. Chem. Phys. 48, 1760–1765 (1968)
https://doi.org/10.1063/1.1668908
Kinetic and Spectroscopic Constraints on the Origin of the N2 Afterglow
J. Chem. Phys. 48, 1765–1768 (1968)
https://doi.org/10.1063/1.1668909
Electric Field Gradient at a (100) Surface of Some Alkali Halide Crystals
J. Chem. Phys. 48, 1780–1783 (1968)
https://doi.org/10.1063/1.1668911
Nature of the Two‐Electron Chemical Bond. VII. Multicenter Bonds and H3+
J. Chem. Phys. 48, 1790–1797 (1968)
https://doi.org/10.1063/1.1668913
Vibrational Relaxation of Anharmonic Oscillators with Exchange‐Dominated Collisions
J. Chem. Phys. 48, 1798–1807 (1968)
https://doi.org/10.1063/1.1668914
Use of the CNDO Method in Spectroscopy. I. Benzene, Pyridine, and the Diazines
J. Chem. Phys. 48, 1807–1813 (1968)
https://doi.org/10.1063/1.1668915
Direct Calculation of Approximate Natural Orbitals and Natural Expansion Coefficients of Atomic and Molecular Electronic Wavefunctions. II. Decoupling of the Pair Equations and Calculation of the Pair Correlation Energies for the Be and LiH Ground States
J. Chem. Phys. 48, 1819–1832 (1968)
https://doi.org/10.1063/1.1668917
Excimer Formation with Polar Molecules: Oxazole and Oxadiazole Derivatives
J. Chem. Phys. 48, 1832–1840 (1968)
https://doi.org/10.1063/1.1668918
Concentration of Clusters in Nucleation and the Classical Phase Integral
J. Chem. Phys. 48, 1849–1852 (1968)
https://doi.org/10.1063/1.1668921
Spectroscopic Studies of Ruthenium(II) Complexes. Assignment of the Luminescence
J. Chem. Phys. 48, 1853–1858 (1968)
https://doi.org/10.1063/1.1668922
COMMUNICATIONS
NOTES
Reduction of the Isotope Effect in Diffusion of Hydrogen in Nickel at Low Temperatures
J. Chem. Phys. 48, 1867–1868 (1968)
https://doi.org/10.1063/1.1668926
Charge‐Exchange Cross Sections of N22+ in N2, CO2 and Ar and Contamination of N+ Beams by N22+
J. Chem. Phys. 48, 1872–1873 (1968)
https://doi.org/10.1063/1.1668930
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.
Dielectric profile at the Pt(111)/water interface
Jia-Xin Zhu, Jun Cheng, et al.