See what you will probably never see in reality, thanks to the PCOD
Two-dimensional B2O3 models (not DFT-optimized) as
predicted by GRINSP
They can be porous too...
Construction of these B2O3 models (3D,
2D, 1D and 0D)
described in 2005 and 2010 in refs. [1 and 8] - BO3 triangles
interconnected exclusively by corner-sharing. See other works in a 2012 paper and in a 2016 thesis.
Data from the 2009 (766 models) and 2010
(5118 models) PCOD updates.
Not exhaustive list (more will be added during the next weeks, maybe)...
References for these GRINSP predictions :
1- Inorganic structure prediction with GRINSP. A. Le Bail, J. Appl. Cryst.
38 (2005) 389-395. http://journals.iucr.org/j/issues/2005/02/00/cg5019/
2- Predicted corner-sharing titanium silicates. A. Le Bail, Z. Kristallogr.,
Suppl. 26 (2007) 203-208. https://www.researchgate.net/publication/228093494_Predicted_corner-sharing_titanium_silicates
3- Powerpoint file : Contribution to the "Gordon Conference Style" Workshop
: Global Optimisation Techniques Applied to the Prediction of Structures,
5-7 July 2006, University College London (.ppt
or zipped)
4- Advances in structure prediction of inorganic compounds. A. Le Bail,
Report of 2nd Algerian Crystallography Congress, Algérie (2005). http://arxiv.org/abs/cond-mat/0606025
5- Hypothetical AlF3 crystal structures, A. Le Bail, F.
Calvayrac, J. Solid State Chem., 179 (2006) 3159-3166.
6- Inorganic structure prediction: too much and not enough, A. Le Bail,
Solid State Phenomena 130 (2007) 1-6.
7- Frontiers between crystal structure prediction and determination by
powder diffractometry, A. Le Bail, Powder Diffraction, S23 (2008) S5-S12.
8- Databases of virtual inorganic crystal structures and their applications,
A. Le Bail, Phys. Chem. Chem. Phys. 12 (2010) 8521-8530. DOI:
10.1039/c003907c
Etc - search by yourself after all...
The following shows that GRINSP may be used for the automatic building
of decorative ceramic plaques for bathrooms or swimming pools ;-).
PCOD1500346 CIF
PCOD1500362 CIF
PCOD1500418 CIF
PCOD1500156 CIF
PCOD1500153 CIF
PCOD1501713 CIF
PCOD1501650 CIF
PCOD1500158 CIF
PCOD1500152 CIF
PCOD1500144 CIF
PCOD1500097 CIF
PCOD1500147 CIF
PCOD1500138 CIF
PCOD1500105 CIF
PCOD1501671 CIF
PCOD1501659 CIF
PCOD1500417 CIF
PCOD1500048 CIF
PCOD1500307 CIF
PCOD1500251 CIF
PCOD1501151 CIF
PCOD1500731 CIF
PCOD1502281 CIF
PCOD1500002 CIF
PCOD1500626 CIF
PCOD1500003 CIF
PCOD1500617 CIF
PCOD1500250 CIF
PCOD1500494 CIF
PCOD1500664 CIF
PCOD1500737 CIF
PCOD1500591 CIF
PCOD1500644 CIF
PCOD1500736 CIF
PCOD1500304 CIF
PCOD1500560 CIF
PCOD1500558 CIF
PCOD1500709 CIF
PCOD1500643 CIF
PCOD1500681 CIF
PCOD1500704 CIF
PCOD1502072 CIF
PCOD1501250 CIF
PCOD1501545 CIF
PCOD1500762 CIF
PCOD1500724 CIF
PCOD1500176 CIF
PCOD1500142 CIF