Quantum state-resolved energy transfer dynamics at gas-liquid interfaces: IR laser studies of CO2 scattering from perfluorinated liquids

Article Abstract:

An apparatus for detailed study of quantum state-resolved energy transfer dynamics at the gas-liquid interface is described. The approach relies on supersonic jet-cooled molecular beams impinging on a continuously renewable liquid surface in a vacuum and exploits sub-Doppler high-resolution laser absorption methods to probe rotational, vibrational, and translational distributions in the scattered flux.

Analysis, Quantum chemistry, Energy transformation

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Some properties of 'Madrid' liquids

Article Abstract:

A study is conducted to examine whether a density independent pair potential that supports a stratified liquid-vapor interface also supports liquid and solid phases with realistic structures and properties. The result obtained is that a 'Madrid' potential generates a solid that supports a premelting stage in the melting transition.

Potential energy

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Absolute free-energy calculations of liquids using a harmonic reference state

Article Abstract:

Absolute free-energy calculations of liquids using a harmonic reference state are described. An expansion of the confinement method was applied to liquids and to explicitly solvated protein or nucleic acid simulations.

Biological Product (except Diagnostic) Manufacturing, Drugs, Nucleic Acids, Protein research

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