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Moreover, there seems to be a considerable potential toward investigating thermodynamic equilibration of reacting compounds for obtaining large molecular cages.
The other unique feature of the apparatus is that it is designed for an expeditious thermodynamic equilibration using a rocking cell with a free-rolling ball inside which allows the effective agitation.
The thermodynamic equilibration (stationary heat energy) temperatures, corresponding to the chemical composition of the discharged gases, were from 200 °C to 600 °C.
The thermodynamic equilibration temperatures, corresponding to the chemical composition of the discharged gases, ranged from 200-600 °C; this is a measure of the temperature at which the gases equilibrated within the volcano.
All the simulations, including conventional molecular dynamics simulations (CMD) which purpose was to make the model systems to reach their thermodynamic equilibration states, and SMD, were carried out using the programs NAMD 2.6 [42] with constant molecular number, pressure, and temperature (NPT) and periodic boundary conditions.
thermodynamic equilibration [2].
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The reversibility of the elimination step allows equilibration, leading to the thermodynamic E-selectivity in acyclic substrates.
A thermodynamic study on Li-poor vapor transport equilibration (VTE) in MgO-doped LiNbO3 crystal was carried out.
Thermodynamic enolates are favored by longer equilibration times at higher temperatures, conditions that give relatively covalent metal oxygen bonding, and use of a slight sub-stoichiometric amount of strong base.
The authors propose that reaction through dialkylcopper species bearing an electron-rich ligand favors equilibration to the π-allyl complex, ultimately delivering the thermodynamic product, 429.
In virtually all relaxation experiments, a thermodynamic equilibrium state is disturbed, and the time required for re-equilibration is measured.
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