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Electronic decay of core hole excited states in molecular oxygen
J. Chem. Phys. 93, 2169–2175 (1990)
https://doi.org/10.1063/1.459048
Analysis of vibronic‐mode coupling in azulene by fully resonant coherent four wave mixing
J. Chem. Phys. 93, 2205–2216 (1990)
https://doi.org/10.1063/1.459053
Single‐crystal electron paramagnetic resonance study of triplet excitons in [Fe(mesitylene)2+2][C3(C(CN)2)−3]2
J. Chem. Phys. 93, 2222–2227 (1990)
https://doi.org/10.1063/1.459055
The theory of electronic intensity in solution or condensed media
J. Chem. Phys. 93, 2238–2245 (1990)
https://doi.org/10.1063/1.459057
Study of the integrated intensity of depolarized light scattering spectra of tetrahedral molecules
J. Chem. Phys. 93, 2246–2257 (1990)
https://doi.org/10.1063/1.459058
Nanosecond and microsecond study of probe reorientation in orthoterphenyl
J. Chem. Phys. 93, 2274–2279 (1990)
https://doi.org/10.1063/1.459060
High‐pressure Raman spectroscopic study of sodium tetrasilicate (Na2Si4O9) glass
J. Chem. Phys. 93, 2280–2288 (1990)
https://doi.org/10.1063/1.459007
Spectral hole burning and holography. III. Electric field induced interference of holograms
J. Chem. Phys. 93, 2299–2307 (1990)
https://doi.org/10.1063/1.459009
Photodissociation of RNCS and RSCN (R=H, CH3, C2H5) at 248 and 193 nm: CN product energy distributions
J. Chem. Phys. 93, 2346–2356 (1990)
https://doi.org/10.1063/1.459014
The effect of density variation on the structure of liquid hydrogen chloride. A Monte Carlo study
J. Chem. Phys. 93, 2357–2363 (1990)
https://doi.org/10.1063/1.459015
A theoretical analysis of nuclear magnetic resonance experiments on proton transfer in benzoic acid crystals
J. Chem. Phys. 93, 2364–2369 (1990)
https://doi.org/10.1063/1.459016
Cluster and barrier effects in the temperature and pressure dependence of the photoisomerization of trans‐stilbene
J. Chem. Phys. 93, 2393–2404 (1990)
https://doi.org/10.1063/1.459020
Kinetics and mechanism studies of switching and association reactions involving Na+–ligand complexes
J. Chem. Phys. 93, 2405–2412 (1990)
https://doi.org/10.1063/1.459021
Calculation of rotational energy transfer rates for HD (v=1) in collisions with thermal HD
J. Chem. Phys. 93, 2413–2417 (1990)
https://doi.org/10.1063/1.459022
Nonequilibrium kinetics of the reaction H+Br2 in xenon within a Lorentz gas model
J. Chem. Phys. 93, 2425–2430 (1990)
https://doi.org/10.1063/1.459699
A crossed‐beam study of the state‐resolved dynamics of CH(X 2Π)+D2. I. The inelastic scattering channel
J. Chem. Phys. 93, 2431–2442 (1990)
https://doi.org/10.1063/1.459024
A crossed‐beam study of the state‐resolved dynamics of CH(X 2Π) + D2. II. The isotopic exchange channel
J. Chem. Phys. 93, 2443–2459 (1990)
https://doi.org/10.1063/1.459025
Calculation of the total scattering cross section for the collision of hard spheres: The atom–diatom case
J. Chem. Phys. 93, 2469–2475 (1990)
https://doi.org/10.1063/1.459027
Two‐pulse coherent control of electronic states in the photodissociation of IBr: Theory and proposed experiment
J. Chem. Phys. 93, 2493–2498 (1990)
https://doi.org/10.1063/1.459031
The application of optical potentials for reactive scattering: A case study
J. Chem. Phys. 93, 2499–2505 (1990)
https://doi.org/10.1063/1.459032
Dissociation dynamics: Measurements of decay fractions of metastable ammonia cluster ions
J. Chem. Phys. 93, 2506–2512 (1990)
https://doi.org/10.1063/1.459033
Ab initio molecular orbital calculations on HBr−2: Geometry, frequencies, and enthalpy changes
J. Chem. Phys. 93, 2530–2536 (1990)
https://doi.org/10.1063/1.458891
Gaussian‐1 theory of molecular energies for second‐row compounds
J. Chem. Phys. 93, 2537–2545 (1990)
https://doi.org/10.1063/1.458892
High precision calculations on the 2S ground state of the lithium atom
J. Chem. Phys. 93, 2570–2574 (1990)
https://doi.org/10.1063/1.458896
A comparative study of density functional models to estimate molecular atomization energies
J. Chem. Phys. 93, 2591–2602 (1990)
https://doi.org/10.1063/1.458899
Electronic structure of Rh, RhH, and Rh2 as derived from ab initio (configuration interaction) calculations
J. Chem. Phys. 93, 2603–2610 (1990)
https://doi.org/10.1063/1.459695
Applications of modified weighted density functional theory: Freezing of simple liquids
J. Chem. Phys. 93, 2692–2700 (1990)
https://doi.org/10.1063/1.458907
Molecular dynamics studies of polar/nonpolar fluid mixtures. I. Mixtures of Lennard‐Jones and Stockmayer fluids
J. Chem. Phys. 93, 2704–2714 (1990)
https://doi.org/10.1063/1.458909
Pressure dependence of the solubility of nitrogen, argon, krypton, and xenon in water
J. Chem. Phys. 93, 2724–2735 (1990)
https://doi.org/10.1063/1.458911
Application of the thermodynamic cycle perturbation method to systems with nonadditive potentials
J. Chem. Phys. 93, 2762–2768 (1990)
https://doi.org/10.1063/1.458915
Reducing quasi‐ergodic behavior in Monte Carlo simulations by J‐walking: Applications to atomic clusters
J. Chem. Phys. 93, 2769–2784 (1990)
https://doi.org/10.1063/1.458863
Br*+CO2 revisited: An interrogation of E–V energy transfer with time‐resolved diode laser spectroscopy
J. Chem. Phys. 93, 2812–2818 (1990)
https://doi.org/10.1063/1.458866
The effect of crystallography on the Hg 5d branching ratios
J. Chem. Phys. 93, 2819–2826 (1990)
https://doi.org/10.1063/1.458867
Fluorescence quenching of the phenanthrene excimer on Al2O3(0001): Coverage and distance dependence
J. Chem. Phys. 93, 2836–2847 (1990)
https://doi.org/10.1063/1.458869
A Monte Carlo estimation of surface diffusion by simulating laser‐induced thermal desorption
J. Chem. Phys. 93, 2871–2878 (1990)
https://doi.org/10.1063/1.458872
The dissociative adsorption of hydrogen: Two‐, three‐, and four‐dimensional quantum simulations
J. Chem. Phys. 93, 2879–2884 (1990)
https://doi.org/10.1063/1.458873
Phase equilibria in copolymer/homopolymer ternary blends: Molecular weight effects
J. Chem. Phys. 93, 2927–2938 (1990)
https://doi.org/10.1063/1.458877
CREST—A program for the exploration of low-energy molecular chemical space
Philipp Pracht, Stefan Grimme, et al.
DeePMD-kit v2: A software package for deep potential models
Jinzhe Zeng, Duo Zhang, et al.