Ab Initio Calculation of Thermodynamic Functions for CO2 Adsorption in Metal-Organic Frameworks: Entropic Effects of Lateral Interactions

DOI

Structure files used in "Ab Initio Calculation of Thermodynamic Functions for CO2 Adsorption in Metal-Organic Frameworks: Entropic Effects of Lateral Interactions"

Identifier
DOI https://datadoi.ee/handle/33/540
Related Identifier https://doi.org/10.1021/jacs.6b08646
Metadata Access https://datadoi.ee/oai/request?verb=GetRecord&metadataPrefix=oai_dc&identifier=oai:datadoi.ee:33/540
Provenance
Creator Sillar, Kaido; Koppel, Ivar
Publisher University of Tartu, Institute of Chemistry, Ravila 14a, 50411 Tartu, Estonia
Publication Year 2023
Rights info:eu-repo/semantics/openAccess; Attribution-NonCommercial 4.0 International; http://creativecommons.org/licenses/by-nc/4.0/
OpenAccess true
Contact University of Tartu, Institute of Chemistry, Ravila 14a, 50411 Tartu, Estonia
Representation
Resource Type Other
Format CIF; XYZ; text/plain; application/octet-stream
Discipline Other