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Issues
15 January 1974
ISSN 0021-9606
EISSN 1089-7690
In this Issue
Magnetic susceptibilities of trivalent lanthanide ions in an octahedral environment
J. Chem. Phys. 60, 393–397 (1974)
https://doi.org/10.1063/1.1681053
Intermode vibrational energy transfer in laser excited CH3Cl
J. Chem. Phys. 60, 398–401 (1974)
https://doi.org/10.1063/1.1681054
Transfer of functional group electronic structure representation between molecules: Ethane from methane
J. Chem. Phys. 60, 402–404 (1974)
https://doi.org/10.1063/1.1681055
Temperature dependence of the isotopic liquid‐vapor fractionation factor for nitric oxide
J. Chem. Phys. 60, 420–426 (1974)
https://doi.org/10.1063/1.1681057
Temperature dependence of vibrational energy transfer from DF (v = 1) to several diatomics
J. Chem. Phys. 60, 427–434 (1974)
https://doi.org/10.1063/1.1681058
Direct correlation function between charges and the equation of state of simple fluids
J. Chem. Phys. 60, 435–439 (1974)
https://doi.org/10.1063/1.1681059
Spontaneous decay of the state of Xe2
J. Chem. Phys. 60, 445–453 (1974)
https://doi.org/10.1063/1.1681061
Electronic‐to‐vibrational energy transfer efficiency in the O(1D)–N2 and O(1D)–CO systems
J. Chem. Phys. 60, 468–477 (1974)
https://doi.org/10.1063/1.1681064
Molecular beam reactions of potassium atoms with ZnCl2, ZnI2, CdI2, HgBr2, and HgI2
J. Chem. Phys. 60, 478–491 (1974)
https://doi.org/10.1063/1.1681065
Effect of magnetic and electric fields on the transport properties of polyatomic gases. I. Formal theory
J. Chem. Phys. 60, 492–503 (1974)
https://doi.org/10.1063/1.1681066
Optical study of the site symmetry distribution in KBr:Sm2+
J. Chem. Phys. 60, 561–571 (1974)
https://doi.org/10.1063/1.1681074
Molecular orbital calculations of the electronic structure of borazane
J. Chem. Phys. 60, 572–578 (1974)
https://doi.org/10.1063/1.1681075
Orientation dependent spin density matrix of tumbling molecules in thermal equilibrium
J. Chem. Phys. 60, 579–583 (1974)
https://doi.org/10.1063/1.1681076
Electrical conductivity and viscosity of supercritical isobutyric acid + water solutions
J. Chem. Phys. 60, 584–590 (1974)
https://doi.org/10.1063/1.1681077
Computer studies of the onset of Brownian motion in a hard sphere fluid
J. Chem. Phys. 60, 591–594 (1974)
https://doi.org/10.1063/1.1681078
Electronic structure of polyethylene: Theory and ESCA measurements
J. Chem. Phys. 60, 595–600 (1974)
https://doi.org/10.1063/1.1681079
Correlation holes and wavefunctions for the 1S, 1P°, and 3P° states of Be, B+, and C2+
J. Chem. Phys. 60, 601–606 (1974)
https://doi.org/10.1063/1.1681080
Electron paramagnetic resonance of 239Pu3+ and 243Am4+ in CeO2 and of 241Pu3+ in ThO2
J. Chem. Phys. 60, 607–609 (1974)
https://doi.org/10.1063/1.1681081
New set of rules of the Slater type on the screening constants and the effective principal quantum numbers
J. Chem. Phys. 60, 620–624 (1974)
https://doi.org/10.1063/1.1681083
Space‐fixed vs body‐fixed axes in atom‐diatomic molecule scattering. Sudden approximations
J. Chem. Phys. 60, 633–639 (1974)
https://doi.org/10.1063/1.1681085
Free radicals in pyrimidines: ESR of x‐irradiated 5‐ethylbarbituric acid and its potassium salt
J. Chem. Phys. 60, 640–644 (1974)
https://doi.org/10.1063/1.1681086
New procedure for generating valence and Rydberg orbitals. I. Atomic oscillator strengths
J. Chem. Phys. 60, 645–649 (1974)
https://doi.org/10.1063/1.1681087
Nonadiabatic molecular collisions: Charge exchange and chemical reaction in the Ar+ + H2 system
J. Chem. Phys. 60, 650–659 (1974)
https://doi.org/10.1063/1.1681088
3B1‐1A1 transition of SO2 gas. I. Franck‐Condon treatment and transition moments
J. Chem. Phys. 60, 660–663 (1974)
https://doi.org/10.1063/1.1681089
3B1‐1A1 transition of SO2 gas. II. Radiative lifetime and radiationless processes
J. Chem. Phys. 60, 664–667 (1974)
https://doi.org/10.1063/1.1681090
Theoretical studies of hydrogen‐rare gas complexes: HenH and HenH+ clusters
J. Chem. Phys. 60, 674–679 (1974)
https://doi.org/10.1063/1.1681092
Computer simulation of (n, γ) recoil damage in hexahalorhenate crystals
J. Chem. Phys. 60, 680–688 (1974)
https://doi.org/10.1063/1.1681093
LETTERS TO THE EDITOR
COMMUNICATIONS
Magnetic circular dichroism: Semiempirical calculation of B terms using the perturbation formula
J. Chem. Phys. 60, 703–704 (1974)
https://doi.org/10.1063/1.1681096
EPR and optical studies of the lowest nπ* triplet state of p‐benzoquinone in an isotopic mixed crystal
J. Chem. Phys. 60, 704–705 (1974)
https://doi.org/10.1063/1.1681097
NOTES
On the solvation of the trapped electron in γ‐irradiated deuterated ethanol glass at 4 K
J. Chem. Phys. 60, 710–711 (1974)
https://doi.org/10.1063/1.1681100
NMR study of high temperature phase transitions in KH2PO4‐type crystals
J. Chem. Phys. 60, 715–716 (1974)
https://doi.org/10.1063/1.1681103
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.
Freezing point depression of salt aqueous solutions using the Madrid-2019 model
Cintia P. Lamas, Carlos Vega, et al.