STRUKTURA  2018      PROGRAMME

Czech verion of the preliminary programme

Preliminary schedule

Day 1 Day 2 Day 3 Day 4
11.00 - 14.00 Registration 7.00 - 8.30  Breakfast 7.00 - 8.30  Breakfast 7.00 - 8.30  Breakfast
14.00 Opening 8.30 - 12.30  Lectures 8.30 - 12.30  Lectures 8.30 - 13.00  Lectures
14.00 - 18.30 Lectures 12.30 - 14.00 Lunch 12.30 - 14.00 Lunch 13.00 - 14.00 Closing, lunch
18.30 - 19.30 Dinner 14.00 - 18.30 Lectures, courses 14.00 - 18.30 Lectures, courses
19.30   Courses 18.30 - 19.30 Dinner 19.00 CSCA assembly
  20.00  Meeting of CSCS scientific board
20.00  Meeting of young crystallographers
20.00 Dinner  

 

Crystallography and structure analysis in physics, biology, chemistry and material research

Computing methods

M. Dušek: Jana2020 - the first children steps of successor of the program Jana2006
K. Poruba, M. Dušek: Universal system for sample administration: development of advanced web application from the point of view of developer
J. Rohlíček: Comparison of solvates of organic compounds by program CrystalCMP
M. Hušák: Advances in structure solution of complicated molecular structures from powder diffraction data
P. Veřtát: FitExc - program for profile fitting in MS Excel
J. Brynda: Solution of protein structures by the program ARCHIMBOLDO
P. Roubíček: A simple program for quantitave phase analysis
Z. Matěj: Software overview for x-ray inverse scanning imaging methods
J. Drahokoupil: Possibilites of computer simulations

Structural databases

F. Laufek: Database of inorganic structures ICSD - Desktop
R. Kužel: Database of powder diffraction data - PDF-4+
J. Hašek: News in CCDC

Kursy

MSTRUCT  (Zdeněk Matěj, Milan Dopita)

Free software for refinement of real structure from powder diffraction data (crystallite size and distribution, microstrain, dislocation density, residual stresses) possible texture and crystal structure constraints

DASH  (Michal Hušák)

Structure solution from powder diffaction data (CCDC licence)

Teaching crystallography

R. Kužel: Use of open acess sources of crystalllographic data and structure visualization in teaching crystallography

News in instruments

Peter Oberta (Rigaku): New Rigaku XRD SmartLab XE
B. Míč (Měřící technika Morava): New detectors from Bruker
Andreas Stricker (Incoatec)
Stoe
Heike Ehmann (Anton Paar): Cellulose nanocrystals - structural insights via 2D q-mapping
Stjepan Prugovečki or Jan Gertenbach (Panalytical)

M. Čurda: Experience with X-ray powder diffractometer Bruker D8 Advance: Automatic divergence slit, „variable counting time“ measurement method

Contributed talks

J. Hašek: Porous catalyzers of protein crystallization
I. Berková: Crystallization studies of novel haloalkane dehalogenase DgaA from Glacieocola agarylitica NO2
M. Marek: Crystallographic studies of HDAC8-inhibitor complexes:
M. Pospíšil: Structural description and properties of Mg2Al-Layered Double Hydroxides intercalated with the fluvastatin drug solved by molecular simulation methods
P. Ryšánek: Surface structure of chemically modified polymeric nanofibers studied by molecular modelling
J. Čapek: Comparison of residual stresses using different method.
K. Trojan: Effects of Advanced Laser Processing on the Microstructure and Residual Stresses of H13 Tool Steel
C. Hervoches: Characterization of residual stress distribution in structural materials by neutron diffraction, at the LVR-15 research reactor in Rez.
M. Černík, P. Vranec: Microstructure of rolled TRIP and DP steels analyzed by X-ray diffraction and EBSD
J. Kopeček: Break up of bulks and binding of powders in the system Fe-Al-Si
R. Skála: Lattice parameters - complications in a simple task
P. Čapková: X-ray diffraction analysis of polymer nanofibers
P. Cejpek: Determination of the content of phases L21 and B2 in Ni2MnGa alloys
E. Duverger-Nédellec: Transitions toward complex electronic states and aperiodic structures in P4W16O56
C. Antunes Correa: Incommensurately modulated crystal structures and phase transitions of Cu3+xSi
R. Pažout: Substitution limits in new mineral staročeskéite, Ag0.7 Pb1.6 Bi1.35 Sb1.35 S6
V. Ryukhtin: In-situ SANS study of precipitates nanostructure in single crystal Ti15Mo
M. Meduňa: Study of defects in epitaxial SiGe graded microcrystals