1,721,106 research outputs found
Prediction of thermophysical properties of alternative refrigerants by a novel, ab initio force field
GCMC Simulations in Zeolite MFI and Activated Carbon for Benzene Removal from Exhaust Gaseous Streams
Estimation of the binding energy in random poly(butylene terephtalate-co-thiodiethylene terephtalate) copolyesters/clay nanocomposites via molecular simulations
Alternative Refrigerants: Thermophysical Properties and Phase equilibra by computational chemistry
Computer Simulation of nylon/organoclay nanocomposites: prediction of the binding energy
Development of an all-atoms force field from ab-initio calculations for alterative refrigerants
Chemical Engineering at the edge of life science. Selected cases of molecular simulations and free-energy calculations for biological and medical applications.
Nylon-6/organoclay nanocomposites: prediction of the binding energy by molecular simulation
Odor emission removal from gaseous streams by the use of zeolites: A molecular simulation approach
- …
