On the Flexibility of Metal-Organic Frameworks
L. Sarkisov1,*, R.L. Martin2, M. Haranczyk2, B. Smit3,4,*
1Institute for Materials and Processes, School of Engineering, University of Edinburgh, Edinburgh, EH9 3JL, United Kingdom.
2Computational Research Division, Lawrence Berkeley National Laboratory, One Cyclotron Road, Mail Stop 50F-1650, Berkeley, California 94720-8139, United States.
3Department of Chemical and Biomolecular Engineering, University of California, Berkeley, California 94720, United States.
4Materials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720-8139, United States.
*Correspondence to: Lev.Sarkisov at ed.ac.uk; Berend-Smit at berkeley.edu
Welcome to the online Supporting Information for the manuscript "On the Flexibility of Metal-Organic Frameworks".
From this webpage you can access the database of materials analyzed in our manuscript, comprising structure models and results of deformation analysis. You can also view animations of each of the flexible and semi-flexible modes identified in these materials by our approach. On each page, there are also links to the Reticular Chemistry Structural Resource (RCSR) database entry for the underlying topology or net of each material.
Finally, below you will find an introductory video describing this work and our procedure for identifying flexibility in metal-organic framework materials. We hope you find this work useful.
Website by Richard L. Martin (richardluismartin at lbl.gov), Lawrence Berkeley National Laboratory, July 2013.