About: A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4)

Facets (new session)
Description
Metadata
Settings
- owl:sameAs
- Inference Rule:

About: A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4) Goto Sponge NotDistinct Permalink

An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

Attributes	Values
rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Adsorption isotherms of methane and nitrogen in porous titanium silicate ETS-4 are calculated using grand canonical Monte Carlo (GCMC) simulations. Self-diffusion coefficients are determined using molecular dynamics (MD) simulations. Properties for pure gases were determined for two of the ideal ETS-4 polymorphs dehydrated at different temperatures, taking into account only the framework atoms of the structure and ignoring the non-framework cations and water molecules. It was observed that equilibrium properties are slightly dependent on the structure selected for idealized polymorphs. Adsorption isotherms of methane and nitrogen in porous titanium silicate ETS-4 are calculated using grand canonical Monte Carlo (GCMC) simulations. Self-diffusion coefficients are determined using molecular dynamics (MD) simulations. Properties for pure gases were determined for two of the ideal ETS-4 polymorphs dehydrated at different temperatures, taking into account only the framework atoms of the structure and ignoring the non-framework cations and water molecules. It was observed that equilibrium properties are slightly dependent on the structure selected for idealized polymorphs. (en)
Title	A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4) A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4) (en)
skos:prefLabel	A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4) A Molecular Simulation Study of Adsorption of Nitrogen and Methane in Titanium Silicate (ETS-4) (en)
skos:notation	RIV/67985858:_____/10:00338991!RIV11-GA0-67985858
http://linked.open...avai/riv/aktivita	P Z
http://linked.open...avai/riv/aktivity	P(1ET400720507), P(GA203/08/0094), P(KAN400720701), P(OC10053), Z(AV0Z40720504)
http://linked.open...iv/cisloPeriodika	2
http://linked.open...vai/riv/dodaniDat	2011
http://linked.open...aciTvurceVysledku	Lísal, Martin
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Ústav chemických procesů AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku	244701
http://linked.open...ai/riv/idVysledku	RIV/67985858:_____/10:00338991
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	adsorption isotherms; grand canonical monte carlo; self diffusion (en)
http://linked.open.../riv/klicoveSlovo	adsorption isotherms grand canonical monte carlo self diffusion
http://linked.open...odStatuVydavatele	CZ - Česká republika
http://linked.open...ontrolniKodProRIV	[3EC2682420A1]
http://linked.open...i/riv/nazevZdroje	Collection of Czechoslovak Chemical Communications
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	3 (xsd:int)
http://linked.open...vavai/riv/projekt	Molecular simulations at extreme experimental conditions: Application of advanced methods to geochemistry Hierarchic nanosystems for microelektronics Computer modeling of structural, dynamical and transport properties of fluids in nanospace DENDRIMERS IN BIOMEDICAL APPLICATIONS
http://linked.open...UplatneniVysledku	2010
http://linked.open...v/svazekPeriodika	75
http://linked.open...iv/tvurceVysledku	Lísal, Martin Brennan, J. K. Siperstein, F. R.
http://linked.open...ain/vavai/riv/wos	000277125800001
http://linked.open...n/vavai/riv/zamer	Investigation of multiphase reacting systems for the design of processes important in synthesis and preparation of novel materials, in energy production and in environmental protection
issn	0010-0765
number of pages	20 (xsd:int)

Faceted Search & Find service v1.16.118 as of Jun 21 2024

Alternative Linked Data Documents: ODE Content Formats:

RDF

ODATA

Microdata

About

OpenLink Virtuoso version 07.20.3240 as of Jun 21 2024, on Linux (x86_64-pc-linux-gnu), Single-Server Edition (126 GB total memory, 59 GB memory in use)
Data on this page belongs to its respective rights holders.
Virtuoso Faceted Browser Copyright © 2009-2024 OpenLink Software