1,721,106 research outputs found
Prediction of thermophysical properties of alternative refrigerants by a novel, ab initio force field
No full textGCMC Simulations in Zeolite MFI and Activated Carbon for Benzene Removal from Exhaust Gaseous Streams
No full textEstimation of the binding energy in random poly(butylene terephtalate-co-thiodiethylene terephtalate) copolyesters/clay nanocomposites via molecular simulations
No full textAlternative Refrigerants: Thermophysical Properties and Phase equilibra by computational chemistry
No full textComputer Simulation of nylon/organoclay nanocomposites: prediction of the binding energy
No full textDevelopment of an all-atoms force field from ab-initio calculations for alterative refrigerants
No full textChemical Engineering at the edge of life science. Selected cases of molecular simulations and free-energy calculations for biological and medical applications.
No full textNylon-6/organoclay nanocomposites: prediction of the binding energy by molecular simulation
No full textOdor emission removal from gaseous streams by the use of zeolites: A molecular simulation approach
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