The report presents results of development of an accurate, physics-based model of vibrational androtational energy transfer in three-dimensional collisions of rotating diatomic molecules, applicable over awide range of collision energies and vibrational / rotational quantum numbers, and results of detailedkinetic modeling studies of state-to-state molecular energy transfer processes...

A wide-ranging computational study of equilibration in binary mixtures of diatomic gases reveals the existence of competition between the constituent species for the orbital angular momentum and energy available on collision with the bath gas. The ensembles consist of a bath gas AB(v;j), and a highly excited minor component CD(v';j'), present in the ratio AB:CD = 10:1. Each ensemble contains 80...

Classical trajectories on rotational energy surfaces and coherent-state quantum projections have been used to study an asymmetric-top molecule containing a freely rotating internal symmetric top whose symmetry axis is not coincident with a principal axis of the molecule. Stationary points on the rotational energy surface, which strongly influence the trajectories, increase in number from two to...

Photofragment yield spectra and NO(X(2)Pi(1/2,3/2); v = 1, 2, 3) product vibrational, rotational, and spin-orbit state distributions were measured following NO dimer excitation in the 4000-7400 cm(-1) region in a molecular beam. Photofragment yield spectra were obtained by monitoring NO(X(2)Pi; v = 1, 2, 3) dissociation products via resonance-enhanced multiphoton ionization. New bands that incl...

We argue that the Robertson-Walker’s Universe is a zero-energy stable one, even though it may possess a rotational state besides expansion.

HX rotational state distributions following vibrational predissociation (VP) of C2H2-HX (X ) Cl, F, O) dimers are predicted by expressing the predissociation process as the joint probability of rovibrational excitation in the fragments following “internal collision” in the vibrationally excited dimer. Calculations of these joint probabilities for the T-shaped dimers of acetylene with HCl, DCl, ...

OBJECTIVE To test the hypothesis that there is no difference in the stability and resistance to rotational moments of early loaded sandblasted and acid-etched (SLA) mini-implants and those of machined-surface implants of the same size and shape. MATERIALS AND METHODS A randomized complete block design was used in 12 skeletally mature male beagle dogs. Ninety-six orthodontic mini-implants were...

IR-IR double-resonance experiments were used to study the state-to-state rotational relaxation of CO with Ne as a collision partner. Rotational levels in the range Ji=2-9 were excited and collisional energy transfer of population to the levels Jf=2-8 was monitored. The resulting data set was analyzed by fitting to numerical solutions of the master equation. State-to-state rate constant matrices...

The state-to-state vibrational predissociation (VP) dynamics of the hydrogen-bonded HCl-H(2)O dimer was studied following excitation of the dimer's HCl stretch by detecting the H(2)O fragment. Velocity map imaging (VMI) and resonance-enhanced multiphoton ionization (REMPI) were used to determine pair-correlated product energy distributions. Following vibrational excitation of the HCl stretch of...