Molecular dynamics studies of sorbates in zeolites: water in ferrierite
- 12 September 1991
- journal article
- Published by Elsevier in Catalysis Today
- Vol. 10 (2) , 177-200
- https://doi.org/10.1016/0920-5861(91)80064-g
Abstract
No abstract availableKeywords
This publication has 74 references indexed in Scilit:
- Short-range order in glycerol. A molecular dynamics studyThe Journal of Chemical Physics, 1989
- Statistical mechanics calculation of the sorption characteristics of argon and nitrogen in dehydrated zeolite 4A by a Monte Carlo method for determining configuration integralsThe Journal of Physical Chemistry, 1987
- Determination of the electric field in zeolites NaA, NaCaA and Ca6A. Calculation from the ionic charge distribution and infrared measurements of the induced band of N2Journal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1986
- Hydration analysis of the intercalated complex of deoxydinucleoside phosphate and proflavin: computer simulationsThe Journal of Physical Chemistry, 1985
- Sorption of argon, oxygen, nitrogen, nitric oxide, and carbon monoxide by hydrogen mordenite, hydrogen ZSM-5 synthetic zeolite, and sodium hydrogen mordenitesThe Journal of Physical Chemistry, 1984
- CNDO/2-FPP atom-in-molecule polarizabilitiesThe Journal of Chemical Physics, 1982
- Single-particle motions in liquid water. II. The hydrodynamic modelThe Journal of Chemical Physics, 1981
- Molecular dynamics and spectra. I. Diatomic rotation and vibrationThe Journal of Chemical Physics, 1981
- Molecular statistical calculation of the thermodynamic adsorption characteristics of zeolites using the atom–atom approximation. Part 3.—Adsorption of hydrocarbonsJournal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1981
- Low-Frequency Motions of H2O Molecules in CrystalsThe Journal of Chemical Physics, 1964