Reticular Chemistry:
Design, Synthesis and Topological Structure Analysis of Porous Materials
Summer School, June 13-18, 2009, Fujian Institute of Rearch on the Structure of Matter, Chine Academy of Sciences, Fuzhou, China
Instructors
Dr. Charlotte Bonneau, ERATO KIP, Japan (charlotte.)
Prof. Michael O'Keeffe. Arizona State University, USA (mokeeffe@asu.edu)
Prof. Xiaodong Zou, Stockholm University, Sweden (zou@struc.su.)
Saturday June 13, 2009
Registration
Sunday June 14, 2009
14:00 – 14.15 welcome and introduction
14:15 – 15.45 lectures
15:45 -16:15 break (tea and coffee)
16:15 - 18:00 lectures
Monday June 15, 2009
08:30 - 10:00 lectures and demonstrations
10:00 - 10:30 break (tea and coffee)
10:30 - 12:00 lectures and demonstrations
12:00 - 14:00 lunch
14:00 - 15:45 lectures and demonstrations
15:45 -16:15 break (tea and coffee)
16:15 - 18:00 lectures and demonstrations
Tuesday June 16, 2009
凸凹视频分类
08:30 - 10:00 lectures and demonstrations
10:00 - 10:30 break (tea and coffee)
10:30 - 12:00 lectures and demonstrations
12:00 - 14:00 lunch
14:00 - 15:45 lectures and demonstrations
15:45 -16:15 break (tea and coffee)
16:15 - 18:00 lectures and demonstrations
Wednesday June 17, 2009
元文08:30 - 10:00 lectures and demonstrations
10:00 - 10:30 break (tea and coffee)题西林壁题目的意思
山药酒10:30 - 12:00 lectures and demonstrations
12:00 - 14:00 lunch
14:00 - 15:45 lectures and demonstrations
15:45 -16:15 break (tea and coffee)
16:15 - 18:00 lectures and demonstrations
School dinner
Thursday June 18, 2009
08:30 - 10:00 lectures and demonstrations
10:00 - 10:30 break (tea and coffee)
10:30 - 12:00 lectures and demonstrations
12:00 - 14:00 lunch
14:00 - 15:45 lectures and demonstrations
15:45 -16:15 break (tea and coffee)
16:15 - 18:00 lectures and demonstrations
End of the School
Preliminary list of the lectures
1. Introduction to MOFs, COFs, ZIFs etc
2. Historical development
3. Some important crystal structures
4 Introduction to graphs
5. Periodic graphs (nets)
19的英文6. Tilings of space
7. Taxonomy of nets and surfaces
8. Taxonomy continued
9. Deconstruction of crystal structures
10. Symmetry
11. Symmetry continued.
12. Structure determination by electron crystallography and powder X-ray diffraction
13. Novel open-framework germanates built from inorganic clusters
Preliminary list of the demonstrations
Demonstration I
Diamond net in SiO2 cristobalite
Part I Recognising simple structure types: basic operations with Systre and TOPOS
Ca 1: The Systre path
Ca 2: The TOPOS way
Part II More on the TOPOS ADS options and output, the .tnt file, the .cgd files and simple
manipulation in 3dt
Demonstration II
Recognising the primary net
Ca 1: dia and crs (dia-e dia edge net)
Ca 2: dia and dia-a (augmented net)
Ca 3: dia and dia-f (expanded net)
Demonstration III
Treating compounds containing inorganic clusters and/or multidentate ligands (>2): Advanced manipulations with TOPOS for crystal deconstruction
Ca 1: Ge7 and Ge9 clusters on csq
Ca 2: Zn paddle wheels on ubt
Ca 3: 1D chains of Zn dimers on connected 2 dia nets
Ca 4: Zn with tridentate ligands on unj
Demonstration IV
Interpenetration: Classification highlights
Ca 1: 6-fold interpenetrated quartz qtz-c6
Ca 2: Self catenation coe and tcn
Ca 3: 2-fold interpenetration pyrite pyr-c2
Demonstration V
Oxides
1998年什么命Zeolite nets (IZA ID card): processing of tetrahedral nets for natural tilings.
Underlying nets in zeolite tetrahedral nets
Demonstration VI (If time)
Constructing a 2D 3dt .ds input file
TOPICS
Introduction to graph theory
cycles, sums, rings, strong rungs
trees, cyclomatic number
planar graphs
polyhedra as graphs
Periodic graphs and nets
crystal structures as nets
embeddability and sphere packings
quotient graphs
minimal nets
regular, miregular nets
秒英语point and vertex symbols
Periodic tilings and nets
natural tilings of nets
signatures
duals
lf-dual tilings and their nets
transitivity
The RCSR databa
symbols for nets
arching the RCSR databa
Using Systre
barycentric coordinates
nets with collisions
滴答歌曲
graph input
crystal input
interpreting output
Using 3dt
Delaney symbols
TILING input
visualization of net and tiling, manipulating tiles
exporting graphics
Deconstructing crystal structures
MOFs, COFs, ZIFs and coordination polymers
zeolites
structure building units and points of extension
