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Computational and experimental design of advanced materials with new functionalities, project No. CZ.02.1.01/0.0/0.0/15.003/0000358, OP RDE 02_15_003 “Excellent Research Teams”

28.1.-1.2.2018: CEDAM will be represented during the workshop Electron and photon spectroscopies of quantum materials:

status and perspectives (EPSQMat2018) where Jan Minar will give invited
presentation "One step model of ARPES: Photoemission response of

This workshop is organised on the honor of
Prof. J. Fink who will soon celenbrate his 80-th Birthday.
CEDAM would like to wish Prof. Fink Happy Birthday and would like to
thank for his longstanding collaboration with us.


18.1.2018: Jan Minar gave invited seminar talk at the University of Würzburg:


5.1.2018: Jan Minar gave plenary talk at "Trojkráľová konferencia 2018"


Jan Očenášek:

Host university: Universitat Politècnica de Catalunya (BarcelonaTech)
Host Professor: Jorge Alcala Cabrelles
Visiting Period: 1st - 30th June 2017

The research fellowship was dedicated to the development of atomistic computer simulations for modelling the piezoelectric effect and the flexoelectrix effect. We were exploring capabilities and limitations of the core-shell approach for adding polarizability in a classical force-field atomistic simulations. The work included implementation of a special-order pair potentials providing promising results.

14.-19.6.2017: Jan Minar stayed at LPMS laboratory at University of Cergy-Pontoise close to Paris.

This ARPES laboratory with its director Prof. Hricovini is main experimental partner of CEDAMNF. During this stay we successfully measured XPS on titanium doped ZnO and we finalized experimental configuration of planed CEDAMNF ARPES laboratory.

IMG_20170516_184758197                    IMG_20170516_100410931

04.05.2017: Jan Minar gave invited seminar talk at the University of Regensburg:


02.05.201/: Jan Minar gave invited talk at the academy of sciences Prague:


After this seminar members of our team, O. Sipr, J. Vackar and M. Novak organized small seminar concerning finite element methods and its application to the density functional theory methods. 

13.-24.3. 2017: DPG Spring Meeting of the Condensed Matter Section, Dresden, Gemany

Jan Minar, Walayt Khan and Saleem Khan took actively part at the German physical society meeting and presented 

following contributed talks:

Theoretical analysis of an Intermediate Band in Sn-doped Hematite with Wide-spectrum Solar Response — Wilayat Khan and Jan Minar

Tuning the electronic structure of Nb3O7(OH) by titanium doping for enhanced light-induced water splitting — Wilayat Khan, •S. Betzler, O. Sipr, Ch. Scheu, and J. Minar

Theoretical investigations of magnetically doped topological insulators — •Jan Minar, Jürgen Braun, Hubert Ebert, Jaime Sanchez-Barriga, Oliver Rader, Jan Honolka, and Andreas Ney


The influence of the Madelung potential on magnetic properties of disordered FePt — •Saleem Ayaz Khan, Peter Blaha, Hubert Ebert, Jan Minár, and Ondřej Šipr

Fermi surface and effective masses in photoemission response of the K doped BaFe2As2 superconductor — Gerald Derondeau, Federico Bisti, Jürgen Braun, Hubert Ebert, Vladimir Strocov, and •Jan Minar

20-23.2.2017: PhD student Saleem Khan visited the Winter School  "Computational Magnetism" in Vienna.