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Microwave spectroscopy of hydroquinone: The rotational spectrum of the cis conformer
J. Chem. Phys. 100, 8569–8572 (1994)
https://doi.org/10.1063/1.466761
Femtosecond electronic dynamics by time‐delayed four‐wave mixing with incoherent light: Iodine and azulene
J. Chem. Phys. 100, 8573–8589 (1994)
https://doi.org/10.1063/1.466762
Theory of natural circular dichroism in molecules oriented by photoselection
J. Chem. Phys. 100, 8602–8613 (1994)
https://doi.org/10.1063/1.466714
Millimeter‐ and submillimeter‐wave spectroscopy of dibridged Si2H2 isotopomers: Experimental and theoretical structure
J. Chem. Phys. 100, 8614–8624 (1994)
https://doi.org/10.1063/1.466715
(σ3s) Rydberg states of cyclohexane, bicyclo[2.2.2]octane, and adamantane
J. Chem. Phys. 100, 8625–8632 (1994)
https://doi.org/10.1063/1.466716
Spin–orbit autoionization and intensities in the double‐resonant delayed pulsed‐field threshold photoionization of HCl
J. Chem. Phys. 100, 8633–8640 (1994)
https://doi.org/10.1063/1.466717
Luminescence properties of Mn5+ in a variety of host lattices: Effects of chemical and structural variation
J. Chem. Phys. 100, 8656–8665 (1994)
https://doi.org/10.1063/1.466720
Vacuum ultraviolet laser/time‐of‐flight mass spectroscopy: Ion‐pair spectra of 79Br35Cl
J. Chem. Phys. 100, 8666–8672 (1994)
https://doi.org/10.1063/1.466721
Ultraviolet spectroscopy of the B 2A′ and C 2A″ states of FCO
J. Chem. Phys. 100, 8673–8680 (1994)
https://doi.org/10.1063/1.466722
Reactions of laser ablated Be atoms with O2: Infrared spectra of beryllium oxides in solid argon
J. Chem. Phys. 100, 8689–8699 (1994)
https://doi.org/10.1063/1.466724
Far infrared laser magnetic resonance detection of CHD (X̃ 3A″)
J. Chem. Phys. 100, 8706–8712 (1994)
https://doi.org/10.1063/1.466726
Strong resonance enhancement of the CN two‐photon absorption B 2Σ+←X 2Σ+(3,0) by the A 2Πi, v′=4 level
J. Chem. Phys. 100, 8713–8719 (1994)
https://doi.org/10.1063/1.467259
Extension of the quasistatic far‐wing line shape theory to multicomponent anisotropic potentials
J. Chem. Phys. 100, 8720–8736 (1994)
https://doi.org/10.1063/1.466727
Vibrational spectroscopy of NO and (NO)2 isolated in solid neon
J. Chem. Phys. 100, 8737–8745 (1994)
https://doi.org/10.1063/1.466728
The forbidden predissociation of metastable H2(c 3Πu−) molecules studied by state specific lifetime measurements
J. Chem. Phys. 100, 8746–8754 (1994)
https://doi.org/10.1063/1.466729
Fluorescence spectra and torsional potential functions for trans‐stilbene in its S and S1(π,π*) electronic states
J. Chem. Phys. 100, 8755–8767 (1994)
https://doi.org/10.1063/1.466730
The electronic transition dipole moment of the B+u→X+g transition in iodine
J. Chem. Phys. 100, 8780–8783 (1994)
https://doi.org/10.1063/1.466732
Observation of doubly excited Rydberg states of N2O by positive ion–negative ion coincidence spectroscopy
J. Chem. Phys. 100, 8817–8824 (1994)
https://doi.org/10.1063/1.466736
Rigorous formula for the mean lifetime of diffusion‐controlled second‐order reactions in solution
J. Chem. Phys. 100, 8825–8840 (1994)
https://doi.org/10.1063/1.466737
Thermal electron attachment to SF4 and SF6
J. Chem. Phys. 100, 8841–8848 (1994)
https://doi.org/10.1063/1.466738
Quantum rearrangement scattering calculations using the invariant imbedding method
J. Chem. Phys. 100, 8869–8876 (1994)
https://doi.org/10.1063/1.466689
Collisional excitation of very high rotational levels of HF in small angle scattering with He+ at Elab=25–50 eV
J. Chem. Phys. 100, 8877–8883 (1994)
https://doi.org/10.1063/1.466690
Interaction between the ion dipole and the ion‐induced dipole in reactions of the polar ion ArH+3
J. Chem. Phys. 100, 8884–8889 (1994)
https://doi.org/10.1063/1.466691
Photodissociation of ketene: CH2(ã 1A1)(0,0,0) rotational state distributions
J. Chem. Phys. 100, 8890–8901 (1994)
https://doi.org/10.1063/1.466692
Photodissociation of ketene: Vibrationally excited CH2(ã 1A1)
J. Chem. Phys. 100, 8902–8906 (1994)
https://doi.org/10.1063/1.466693
Energetics of C+16 to C+36 photodissociation
J. Chem. Phys. 100, 8912–8919 (1994)
https://doi.org/10.1063/1.466695
Construction principle for stable multiply‐negative charged molecular systems. Part I. Doubly‐negative charged systems
J. Chem. Phys. 100, 8934–8942 (1994)
https://doi.org/10.1063/1.466698
Construction principle for stable multiply‐negative charged molecular systems. Part II. Triply‐negative charged systems
J. Chem. Phys. 100, 8943–8955 (1994)
https://doi.org/10.1063/1.466699
An ab initio molecular orbital study of the unimolecular dissociation reactions of vinylchloride
J. Chem. Phys. 100, 8976–8990 (1994)
https://doi.org/10.1063/1.466702
On the radiative lifetime of the (a 4Σ−,v,N,Fi) levels of the CH radical: An ab initio treatment
J. Chem. Phys. 100, 8991–8998 (1994)
https://doi.org/10.1063/1.466703
Coherent and dissipative wave packet dynamics in cyclic model systems with four equivalent potential minima
J. Chem. Phys. 100, 9007–9017 (1994)
https://doi.org/10.1063/1.466705
Local density component of the Lee–Yang–Parr correlation energy functional
J. Chem. Phys. 100, 9018–9024 (1994)
https://doi.org/10.1063/1.466706
Separation‐shifted scaling, a new scaling method for Lennard‐Jones interactions in thermodynamic integration
J. Chem. Phys. 100, 9025–9031 (1994)
https://doi.org/10.1063/1.466707
Temperature‐dependent vibrational relaxation in polyatomic liquids: Picosecond infrared pump–probe experiments
J. Chem. Phys. 100, 9035–9043 (1994)
https://doi.org/10.1063/1.466709
Solvated alkali atoms and electron‐transfer paramagnetic ion pairs: Some common trends from computer simulation studies
J. Chem. Phys. 100, 9044–9049 (1994)
https://doi.org/10.1063/1.466710
Finite representation of an infinite bulk system: Solvent boundary potential for computer simulations
J. Chem. Phys. 100, 9050–9063 (1994)
https://doi.org/10.1063/1.466711
An analytic equation of state and structural properties of nonadditive hard sphere mixtures
J. Chem. Phys. 100, 9064–9074 (1994)
https://doi.org/10.1063/1.466712
Statistical‐mechanical equation of state for nonpolar fluids: Prediction of phase boundaries
J. Chem. Phys. 100, 9075–9087 (1994)
https://doi.org/10.1063/1.466713
The microscopic dynamics of freezing in supercooled colloidal fluids
J. Chem. Phys. 100, 9088–9095 (1994)
https://doi.org/10.1063/1.466662
Solvation forces and colloidal stability: A combined Monte Carlo and density functional theory approach
J. Chem. Phys. 100, 9106–9116 (1994)
https://doi.org/10.1063/1.466664
Low‐energy electron scattering cross sections of halofluorocarbons
J. Chem. Phys. 100, 9117–9122 (1994)
https://doi.org/10.1063/1.466665
Change of bond length in free‐energy simulations: Algorithmic improvements, but when is it necessary?
J. Chem. Phys. 100, 9129–9139 (1994)
https://doi.org/10.1063/1.466667
Thermodynamics of a fluid confined to a slit pore with structured walls
J. Chem. Phys. 100, 9140–9146 (1994)
https://doi.org/10.1063/1.466668
New integral equation theory for primitive model ionic liquids: From electrolytes to molten salts
J. Chem. Phys. 100, 9147–9155 (1994)
https://doi.org/10.1063/1.466669
Aggregation in grafted polymers with attractive end groups
J. Chem. Phys. 100, 9170–9174 (1994)
https://doi.org/10.1063/1.466671
High‐field hopping mobility in disordered molecular solids: A Monte Carlo study of off‐diagonal disorder effects
J. Chem. Phys. 100, 9175–9180 (1994)
https://doi.org/10.1063/1.466672
Classical dynamics of adsorbate–surface systems: Application to nonthermal desorption
J. Chem. Phys. 100, 9205–9214 (1994)
https://doi.org/10.1063/1.466675
365 nm photon‐induced dynamics of ClNO adsorbed on MgO(100)
J. Chem. Phys. 100, 9228–9237 (1994)
https://doi.org/10.1063/1.466676
Metal/conjugated polymer interfaces: A local density functional study of aluminum/polyene interactions
J. Chem. Phys. 100, 9258–9264 (1994)
https://doi.org/10.1063/1.466678
Detection of the perpendicular à state transitions of CH3I by imaging of photofragment angle‐velocity distributions
J. Chem. Phys. 100, 9265–9268 (1994)
https://doi.org/10.1063/1.466679
Evidence for quantization of the transition state for cis–trans isomerization
J. Chem. Phys. 100, 9269–9271 (1994)
https://doi.org/10.1063/1.466680
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.