Grau-Crespo, R and Acuay, E and Ruiz-Salvador, RR (2002) A free energy minimisation study of the monoclinic-orthorhombic transition in MFI zeolite. CHEM COMMUN (21) 2544 - 2545. 10.1039/b208064h.
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Abstract
Free energy minimisation calculations of the crystal structure of the zeolite MFI are shown to reproduce the observed phase transition from monoclinic to orthorhombic symmetry.
| Type: | Article |
|---|---|
| Title: | A free energy minimisation study of the monoclinic-orthorhombic transition in MFI zeolite |
| DOI: | 10.1039/b208064h |
| Keywords: | COMPUTER-SIMULATION, ZSM-5, SILICALITE, FRAMEWORK, H-ZSM-5 |
| UCL classification: | UCL > School of BEAMS > Faculty of Maths and Physical Sciences > Chemistry |
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