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The Ar–HF intermolecular potential: Overtone spectroscopy and ab initio calculations
J. Chem. Phys. 99, 9337–9349 (1993)
https://doi.org/10.1063/1.465518
Rotational analysis of n=4–7 Rydberg states of CO observed by ion‐dip spectroscopy
J. Chem. Phys. 99, 9350–9365 (1993)
https://doi.org/10.1063/1.465519
High resolution electronic spectroscopy of ZnCH3 and CdCH3
Timothy M. Cerny; Xue Qing Tan; James M. Williamson; Eric S. J. Robles; Andrew M. Ellis; Terry A. Miller
J. Chem. Phys. 99, 9376–9388 (1993)
https://doi.org/10.1063/1.465521
Vibrational band shape analysis of the C–H vibration of CH2I2 molecules in liquid CCl4
J. Chem. Phys. 99, 9389–9393 (1993)
https://doi.org/10.1063/1.465522
Pure rotational spectrum and structure of the benzene–CO van der Waals complex
J. Chem. Phys. 99, 9394–9399 (1993)
https://doi.org/10.1063/1.465523
Vibrational ab initio calculations and spectra of C–H bonds of trimethylboron
J. Chem. Phys. 99, 9412–9419 (1993)
https://doi.org/10.1063/1.465475
Stark effect measurement in samarium monoxide: Dipole moments of the [16.6]1 and X− states
J. Chem. Phys. 99, 9420–9427 (1993)
https://doi.org/10.1063/1.465476
Structural transitions and thermally averaged infrared spectra of small methanol clusters
J. Chem. Phys. 99, 9428–9437 (1993)
https://doi.org/10.1063/1.465477
Intensities of CH‐ and CD‐stretching overtones in 1,3‐butadiene and 1,3‐butadiene‐d6
J. Chem. Phys. 99, 9438–9452 (1993)
https://doi.org/10.1063/1.465478
The effect of internal rotation on the methyl CH‐stretching overtone spectra of toluene and the xylenes
J. Chem. Phys. 99, 9453–9459 (1993)
https://doi.org/10.1063/1.465479
Dynamics of CS2 in the large spectral bandwidth stimulated Rayleigh‐wing scattering
J. Chem. Phys. 99, 9460–9464 (1993)
https://doi.org/10.1063/1.465480
Vibronic analysis of the Ã→X̃ laser‐induced fluorescence of jet‐cooled methoxy (CH3O) radical
J. Chem. Phys. 99, 9465–9471 (1993)
https://doi.org/10.1063/1.465481
Rovibronic interactions in NO2 around 17 700 cm−1 observed by Zeeman effect and anticrossing experiments
J. Chem. Phys. 99, 9482–9495 (1993)
https://doi.org/10.1063/1.465483
Theoretical potential energy functions and rovibronic spectrum of electronically excited states of HCO+
J. Chem. Phys. 99, 9512–9520 (1993)
https://doi.org/10.1063/1.465485
Relaxation of vibrationally excited HCl molecules in the H2O–HCl collision complex
J. Chem. Phys. 99, 9521–9531 (1993)
https://doi.org/10.1063/1.465486
Flux–flux correlation function study of resonance effects in reactive collision
J. Chem. Phys. 99, 9547–9552 (1993)
https://doi.org/10.1063/1.465488
Evidence for the deep potential well of Li+HF from backward glory scattering
J. Chem. Phys. 99, 9598–9602 (1993)
https://doi.org/10.1063/1.465492
Alignment of Hg–Ar van der Waals molecule photofragments following photodissociation
J. Chem. Phys. 99, 9608–9615 (1993)
https://doi.org/10.1063/1.465494
Vibrational predissociation of 9,10‐dichloroanthracene—Mixed and homo rare gas atom clusters
J. Chem. Phys. 99, 9616–9628 (1993)
https://doi.org/10.1063/1.465495
Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces
J. Chem. Phys. 99, 9637–9651 (1993)
https://doi.org/10.1063/1.465497
A lower bound on the loss of graphite by atomic oxygen attack at asymptotic energy
J. Chem. Phys. 99, 9652–9663 (1993)
https://doi.org/10.1063/1.465498
Gas‐phase reactivity of sulphur ions with ammonia
J. Chem. Phys. 99, 9664–9669 (1993)
https://doi.org/10.1063/1.465499
Thermionic emission from free, photoexcited tungsten clusters
J. Chem. Phys. 99, 9670–9680 (1993)
https://doi.org/10.1063/1.465500
Combining the discrete variable representation with the S‐matrix Kohn method for quantum reactive scattering
J. Chem. Phys. 99, 9681–9696 (1993)
https://doi.org/10.1063/1.465450
Invariant imbedding method for multichannel Schrödinger equations with first derivative coupling
J. Chem. Phys. 99, 9704–9708 (1993)
https://doi.org/10.1063/1.465452
Vibrational levels for the lowest‐lying triplet and singlet states of CH2 and NH+2
J. Chem. Phys. 99, 9709–9719 (1993)
https://doi.org/10.1063/1.465453
One‐electron and electron pair densities of first‐row hydrides in momentum space
J. Chem. Phys. 99, 9745–9755 (1993)
https://doi.org/10.1063/1.465456
Density functional calculations of isotropic hyperfine coupling constants of radical cations
J. Chem. Phys. 99, 9756–9763 (1993)
https://doi.org/10.1063/1.465457
Theoretical study of the ground states of the rare‐gas hydrides, HeH, NeH, and ArH
J. Chem. Phys. 99, 9776–9782 (1993)
https://doi.org/10.1063/1.466206
A coupled‐cluster study of XNO (X=H,F,Cl): An investigation of weak X–N single bonds
J. Chem. Phys. 99, 9783–9789 (1993)
https://doi.org/10.1063/1.465460
Mechanism of bifurcation along the reaction path: An application in the case of thioformaldehyde
J. Chem. Phys. 99, 9806–9814 (1993)
https://doi.org/10.1063/1.465462
A new solution of the Ornstein–Zernike equation from the perturbation theory
J. Chem. Phys. 99, 9828–9835 (1993)
https://doi.org/10.1063/1.465465
Ellipsometric measurement of a surface amplitude ratio near a critical end point
J. Chem. Phys. 99, 9836–9841 (1993)
https://doi.org/10.1063/1.465466
Stability domain of the ice VIII proton‐ordered phase at very high pressure and low temperature
J. Chem. Phys. 99, 9842–9846 (1993)
https://doi.org/10.1063/1.465467
Dielectric and thermodynamic response of a generalized reaction field model for liquid state simulations
J. Chem. Phys. 99, 9847–9852 (1993)
https://doi.org/10.1063/1.465468
A local dynamical scaling behavior of the Ostwald ripening in nonuniform systems
J. Chem. Phys. 99, 9853–9864 (1993)
https://doi.org/10.1063/1.465469
Study of α‐, β‐, and γ‐relaxation processes in some supercooled liquids and supercooled plastic crystals
J. Chem. Phys. 99, 9865–9873 (1993)
https://doi.org/10.1063/1.465470
High order and local structure of water determined by microwave dielectric study
J. Chem. Phys. 99, 9874–9881 (1993)
https://doi.org/10.1063/1.465471
Thermodynamic properties of planar square‐well dumbbell fluids: Monte Carlo simulations and perturbation theory
J. Chem. Phys. 99, 9882–9889 (1993)
https://doi.org/10.1063/1.465472
Superselectivity and solvation forces of a two component fluid adsorbed in slit micropores
J. Chem. Phys. 99, 9890–9898 (1993)
https://doi.org/10.1063/1.465473
The mutual diffusion coefficient for the van der Waals binary mixture of type I
J. Chem. Phys. 99, 9899–9911 (1993)
https://doi.org/10.1063/1.465474
Mathematical double points according to the simplified–perturbed‐hard‐chain theory
J. Chem. Phys. 99, 9920–9929 (1993)
https://doi.org/10.1063/1.465390
Configurational entropy of microemulsions: The fundamental length scale
J. Chem. Phys. 99, 9930–9937 (1993)
https://doi.org/10.1063/1.465391
Solvation dynamics in liquid water. A novel interplay between librational and diffusive modes
J. Chem. Phys. 99, 9938–9943 (1993)
https://doi.org/10.1063/1.465392
Structure and dynamics of simulated (SF6)N clusters in the size range N=7–55
J. Chem. Phys. 99, 9944–9953 (1993)
https://doi.org/10.1063/1.465393
Effect of pressure on intermolecular and intramolecular phonons in solid C60
J. Chem. Phys. 99, 10001–10010 (1993)
https://doi.org/10.1063/1.465504
Hot carrier induced photodesorption dynamics of SO2 from Ag(111)
J. Chem. Phys. 99, 10021–10033 (1993)
https://doi.org/10.1063/1.465506
Kinetics of concentration fluctuations and spinodal decomposition in star/star and star/linear polymer blends
J. Chem. Phys. 99, 10034–10040 (1993)
https://doi.org/10.1063/1.465507
Dynamics of molecular surface diffusion: Energy distributions and rotation–translation coupling
J. Chem. Phys. 99, 10041–10051 (1993)
https://doi.org/10.1063/1.465508
Calculation of linear and nonlinear optical response of model Langmuir–Blodgett films
J. Chem. Phys. 99, 10059–10067 (1993)
https://doi.org/10.1063/1.465510
Full‐dimensional quantum mechanical calculation of the rate constant for the H2+OH→H2O+H reaction
J. Chem. Phys. 99, 10078–10081 (1993)
https://doi.org/10.1063/1.465514
Influence of retardation on the higher‐order multipole dispersion contributions to the helium dimer potential
J. Chem. Phys. 99, 10084–10085 (1993)
https://doi.org/10.1063/1.465516
Erratum: Rydberg∼valence perturbations in matrix‐isolated NO [J. Chem. Phys. 97, 2881 (1992)]
J. Chem. Phys. 99, 10088 (1993)
https://doi.org/10.1063/1.466242
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.
Rubber wear: Experiment and theory
B. N. J. Persson, R. Xu, et al.