Skip Nav Destination
Issues
High‐pressure ultrasonic investigation of the order–disorder transition in ND4Cl
J. Chem. Phys. 68, 4771–4773 (1978)
https://doi.org/10.1063/1.435656
Infrared spectra of chemisorbed CO on Rh/γ–Al2O3: Site distributions and molecular mobility
J. Chem. Phys. 68, 4774–4780 (1978)
https://doi.org/10.1063/1.435657
Magnetic properties of linear chain systems: Metamagnetism of single crystal Co(pyridine)2Cl2
J. Chem. Phys. 68, 4781–4789 (1978)
https://doi.org/10.1063/1.435658
An optical study of the temperature dependent scattering of the a exciton (polariton) of naphthalene
J. Chem. Phys. 68, 4790–4803 (1978)
https://doi.org/10.1063/1.435659
Raman spectra from the internal vibrations of NH+4 ions in NH4Ag4I5
J. Chem. Phys. 68, 4804–4808 (1978)
https://doi.org/10.1063/1.435660
Generalized valence‐bond investigation of the reaction H+Br2 →HBr+Br
J. Chem. Phys. 68, 4809–4822 (1978)
https://doi.org/10.1063/1.435661
N (1Ag), T (3B1u), and V (1B1u) states of vertical ethylene
J. Chem. Phys. 68, 4839–4847 (1978)
https://doi.org/10.1063/1.435637
Decay rates of Ar(4s,3P2), Ar(4s′,3P), Kr(5s,3P2), and Xe(6s,3P2) atoms in argon
J. Chem. Phys. 68, 4848–4859 (1978)
https://doi.org/10.1063/1.435638
Optical absorption and photoconductivity spectra of localized electrons in x‐irradiated aqueous 10M lithium chloride glasses at 4.2 K: Support for two types of localized electrons each with overlapping bound–bound and bound–continuum transitions
J. Chem. Phys. 68, 4864–4869 (1978)
https://doi.org/10.1063/1.435640
Self‐consistent field theories of the polymer excluded volume problem. IV. The linear polymer
J. Chem. Phys. 68, 4878–4895 (1978)
https://doi.org/10.1063/1.435643
Theoretical studies of MHD plasma molecules. I. Potential energy curves and dipole moments of linear KOH
J. Chem. Phys. 68, 4896–4900 (1978)
https://doi.org/10.1063/1.435644
Calculated long‐range interactions and low energy scattering in He+H, Ne+H, Ar+H, Kr+H, and Xe+H
J. Chem. Phys. 68, 4917–4929 (1978)
https://doi.org/10.1063/1.435648
On the contribution of intramolecular zero point energy to the equation of state of solid H2
J. Chem. Phys. 68, 4933–4935 (1978)
https://doi.org/10.1063/1.435650
Vibrational energy relaxation and exchange in liquid N2–CO–OCS mixtures
J. Chem. Phys. 68, 4941–4949 (1978)
https://doi.org/10.1063/1.435652
Collision‐induced ion‐pair formation of CsCl and Cs2Cl2
J. Chem. Phys. 68, 4950–4968 (1978)
https://doi.org/10.1063/1.435653
Optical–optical double resonance with two dye lasers: Rotational analysis of the E 2Σ–B2Σ system of Ca35Cl
J. Chem. Phys. 68, 4977–4982 (1978)
https://doi.org/10.1063/1.435655
Multiphonon transitions in microcrystalline reflectivity of sodium nitrate
J. Chem. Phys. 68, 4983–4985 (1978)
https://doi.org/10.1063/1.435611
Optical spectroscopy of monolayers of simple molecules adsorbed on copper
J. Chem. Phys. 68, 4992–5000 (1978)
https://doi.org/10.1063/1.435613
Study of the Ar–N2 interaction. I. Electron gas model (Gordon–Kim model) potential calculation
J. Chem. Phys. 68, 5001–5005 (1978)
https://doi.org/10.1063/1.435614
The x‐ray photoelectron spectrum of atomic sodium
J. Chem. Phys. 68, 5006–5009 (1978)
https://doi.org/10.1063/1.435615
Static semiclassical response of a bounded electron gas. II. The finite barrier model
J. Chem. Phys. 68, 5010–5019 (1978)
https://doi.org/10.1063/1.435616
Experimental study of nucleation in binary mixtures: The nitric acid–water and sulfuric acid–water systems
J. Chem. Phys. 68, 5020–5027 (1978)
https://doi.org/10.1063/1.435617
Effect of asymmetric isotopic substitution on atom–diatom potentials
J. Chem. Phys. 68, 5028–5031 (1978)
https://doi.org/10.1063/1.435618
Metastable states in the system water–ethanol. Existence of a second hydrate; curious properties of both hydrates
J. Chem. Phys. 68, 5032–5041 (1978)
https://doi.org/10.1063/1.435619
The residual energy and entropy of hydrocarbon liquids and their relation to the liquid structure
J. Chem. Phys. 68, 5046–5052 (1978)
https://doi.org/10.1063/1.435621
Light scattering near the plait point of a ternary liquid mixture: Ethanol–water–chloroform
J. Chem. Phys. 68, 5066–5068 (1978)
https://doi.org/10.1063/1.435624
Cubic force constants and equilibrium geometry of methane from Hartree–Fock and correlated wavefunctions
J. Chem. Phys. 68, 5077–5085 (1978)
https://doi.org/10.1063/1.435626
A CNDO/S assessment of the electronic structure of p‐benzoquinone and tetrafluoro‐p‐benzoquinone
J. Chem. Phys. 68, 5086–5096 (1978)
https://doi.org/10.1063/1.435627
The low Reynolds number translational friction of ellipsoids, cylinders, dumbbells, and hollow spherical caps. Numerical testing of the validity of the modified Oseen tensor in computing the friction of objects modeled as beads on a shell
J. Chem. Phys. 68, 5097–5102 (1978)
https://doi.org/10.1063/1.435628
Excited intermediates in the Hg‐photosensitized reaction of O2 detected by energy transfer
J. Chem. Phys. 68, 5103–5111 (1978)
https://doi.org/10.1063/1.435610
Chemi‐ionization in collisions of metastable helium with metastable helium
J. Chem. Phys. 68, 5112–5117 (1978)
https://doi.org/10.1063/1.435629
Theory of V–V and V–T/R energy transfer for HF (n=1 to 7)+HF (0)
J. Chem. Phys. 68, 5128–5138 (1978)
https://doi.org/10.1063/1.435632
Librational modes in partially disordered NH4Br below its 235°K disorder–order phase transition temperature
J. Chem. Phys. 68, 5139–5143 (1978)
https://doi.org/10.1063/1.435633
Electron mobilities and ranges in methyl substituted pentanes through the liquid and critical regions
J. Chem. Phys. 68, 5144–5150 (1978)
https://doi.org/10.1063/1.435634
Solution of the Smoluchowski equation with a Coulomb potential. I. General results
J. Chem. Phys. 68, 5163–5171 (1978)
https://doi.org/10.1063/1.435636
Solution of the Smoluchowski equation with a Coulomb potential. II. Application to fluorescence quenching
J. Chem. Phys. 68, 5172–5176 (1978)
https://doi.org/10.1063/1.435581
Spectroscopic studies of diatomic noble gas halides. III. Analysis of XeF 3500 Å band system
J. Chem. Phys. 68, 5177–5186 (1978)
https://doi.org/10.1063/1.435582
Existence of the dielectric constant in fluids of nonlinear rigid polar molecules
J. Chem. Phys. 68, 5199–5202 (1978)
https://doi.org/10.1063/1.435584
The ESR study of the ĊF3⋅⋅⋅F radical in irradiated trifluoroacetamide single crystals
J. Chem. Phys. 68, 5219–5224 (1978)
https://doi.org/10.1063/1.435588
The electronic structure and the optical and photoelectron spectra of carbon subsulfide
J. Chem. Phys. 68, 5231–5243 (1978)
https://doi.org/10.1063/1.435590
Theory of short range interactions and static polarizabilities of alkali halides
J. Chem. Phys. 68, 5244–5249 (1978)
https://doi.org/10.1063/1.435591
Coupling‐strength incoherence and the theory of resonances for a system of several sparse states and quasicontinua
J. Chem. Phys. 68, 5250–5264 (1978)
https://doi.org/10.1063/1.435592
Transfer of vibrational energy to oscillatory, restricted rotational, and translational motion in HCl+Cl
J. Chem. Phys. 68, 5265–5270 (1978)
https://doi.org/10.1063/1.435593
An atom–dipole interaction theory of the hyperpolarizability contribution to the optical activity of molecules
J. Chem. Phys. 68, 5271–5276 (1978)
https://doi.org/10.1063/1.435609
Effect of spin polarization on the thermal conductivity of polyatomic gases
J. Chem. Phys. 68, 5277–5282 (1978)
https://doi.org/10.1063/1.435594
Calculation of the photoionization cross section of the 1Σu+ excimer state of Ar2
J. Chem. Phys. 68, 5283–5284 (1978)
https://doi.org/10.1063/1.435595
The use of optical enantiomers in studying the mechanism of chlorine‐38 for chlorine substitution in condensed phase
J. Chem. Phys. 68, 5285–5286 (1978)
https://doi.org/10.1063/1.435596
Quenching cross sections for Ar(3P0,2) and Kr(3P0,2) by H2O and D2O
J. Chem. Phys. 68, 5288–5289 (1978)
https://doi.org/10.1063/1.435598
Calculation of proton affinities with the integral Hellmann–Feynman theorem
J. Chem. Phys. 68, 5289–5291 (1978)
https://doi.org/10.1063/1.435599
On the conversion of atomic rare gas ions X+ (2P1/2) into rare gas dimer ions
J. Chem. Phys. 68, 5301–5302 (1978)
https://doi.org/10.1063/1.435606
Note on Miller’s method to compute partition functions for the case of hard spheres
J. Chem. Phys. 68, 5302–5303 (1978)
https://doi.org/10.1063/1.435607
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.