30 research outputs found
A New Algorithm of Boundary-Driven Type Non-Equilibrium Molecular Dynamics for Simulating Membrane Permeation of Gas Mixtures
No full textThe Time of Arrival of Electrons in the Double-Slit Experiment
No full textUsing Nelson's stochastic mechanics, quantum motion of electrons in the double-slit experiment is studied numerically. It is found that not only the distribution of arrival positions but also that of arrival times at the screen forms an interference pattern. Quantum-mechanical presence time and arrival time are also calculated in comparison with stochastic-mechanical results
Effects of surface topography on adsorption isotherms of mobile molecules: comparison of patchwise and random surfaces
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Non-equilibrium molecular dynamics for simulating permeation of gas mixtures through nanoporous carbon membranes.
No full textSolubilities of nitrogen in binary solutions. Mixtures of ethanol with benzene, ethyl acetate, and diethyl ether
No full textIR spectra of adsorption on silica gel for acetonitrile, tetrahydrofuran, diethyl ether and methanol-d diluted in supercritical carbon dioxide.
No full textNon-Equilibrium MD Simulation Studies on Effects of Structural Difference in Outer Surfaces of a Silicalite Membrane on Effusion Processes of Propane
No full textReal Space Ab Initio Molecular Dynamics Simulations for the Reactions of OH Radical/OH Anion with Formaldehyde
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