Framework silica structures generated using simulated annealing with a potential energy function based on an H6Si2O7 molecule
- 1 September 1994
- journal article
- Published by Springer Nature in Physics and Chemistry of Minerals
- Vol. 21 (5) , 269-284
- https://doi.org/10.1007/bf00202091
Abstract
No abstract availableKeywords
This publication has 20 references indexed in Scilit:
- A modeling of the structure and compressibility of quartz with a molecular potential and its transferability to cristobalite and coesitePhysics and Chemistry of Minerals, 1993
- Framework crystal structure solution by simulated annealing: test application to known zeolite structuresJournal of the American Chemical Society, 1992
- Relation between crystal symmetry and ionicity in silica polymorphsNature, 1991
- X-ray powder diffraction patterns and phase relationship of tridymite modificationsZeitschrift für Kristallographie, 1991
- Local Density Approximation Total Energy Calculations for Silica and Titania Structure and DefectsJournal of the American Ceramic Society, 1990
- Force fields for silicas and aluminophosphates based onab initiocalculationsPhysical Review Letters, 1990
- Determination of 4-connected framework crystal structures by simulated annealingNature, 1989
- Framework density distribution of zeolite-type tetrahedral netsNature, 1989
- A modeling of the coesite and feldspar framework structure types of silica as a function of pressure using modified electron gas methodsThe Journal of Physical Chemistry, 1988
- A note on the sluggish silica transformationsZeitschrift für Kristallographie, 1959