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Seminars archive

Seminar topics and presentations

 

July 2014

 

03.07.2014

Gabriele Saleh

Lecture: Noncovalent interactions pdf

10.07.2014

Xiaohu Yu

Lecture: Magic number of nanoclusters pdf

17.07.2014

Igor Blinov

Lecture: Physical properties of quasicrystals

 

 

June 2014

 

05.06.2014


Joint seminar with BioFarmCluster at MIPT

19.06.2014

Fei Qi

Lecture: Multidimensional Regression

26.06.2014

Qinggao Wang

Report: Surface reconstruction of anatase TiO2

 

May 2014

 

08.05.2014

Fei Qi

Lecture: Linear Regression pdf

15.05.2014

Qinggao Wang

Lecture: USPEX revolution in surface reconstruction

22.05.2014

Artem Oganov

Report about recent discoveries

Nikita Mazko

Report about silicon hydrates studies

29.05.2014

Artem Oganov

Report about recent discoveries

 

April 2014

 

  

03.04.2014

Haiyang Niu

Report: Application of STM4 for analysis of USPEX calculations results

  07.04.2014

Guangrui Qian

Report: New features and new architecture USPEX 10.0

  10.04.2014

  Yuri Fomin

LectureMolecular simulation of melting pdf

  17.04.2014

 Gabriele Saleh

Lecture: Noncovalent interactions pdf

  24.04.2014

Haiyang Niu

Lecture: New features and new architecture   USPEX  10.0

  29.04.2014

Xiaohu Yu

Lecture: Nanocluster and theoretical simulation pdf

 

March 2014

 

06.03.2014

Valeriy Roizen

Review: application of the statictical analysis for cocrystals prediction

Ivan Kruglov

Review: Self - Consistent - Field (SCF) procedure and Basis sets

Xiaohu Yu

Report: Investigation of CeO clusters by USPEX

 13.03.2014

Gabriele Saleh

Lecture: Definition of ELF and its applications, with particular focus on high-pressure chemistry   
(
http://www.cpfs.mpg.de/ELF/index.php?content=01quant/01def.txt)

Qinggao Wang

Lecture: the comparison between proposed atomic models and the structures predicted by USPEX calculation

Oleg Feia

Report: New metastable superhard incommensurate carbon structure

 20.03.2014

Igor Blinov

Report: Nash and Pareto equilibrium in application to cluster computations.

 

February 2014

 

06.02.2014

Oleg Feia

Review: program Phonopy

 13.02.2014

Ivan Kruglov

Review: Introduction to EST

 20.02.2014

Ivan Kruglov

Review: Hartree - Fock MO theory

 

Qinggao Wang

Report: TiO2 surface reconstruction

 27.02.2014

Igor Blinov

Review: numerical and analytical methods in quasicrystals

 

January 2014

 

16.01.2014

Oleg Feia

Report: Bader charges

  30.01.2014

Igor Blinov

Review: long- and short-range order in quasicrystals 

 

December 2013

 

05.12.2013

Gabriele Saleh

Lecture: COHP and COOP: definition and an overview of its applications

  12.12.2013

Alexey Lukoyanov Vladimir Anisimov

Lecture: Density-functional theory and strong interactions: Orbital ordering in Mott-Hubbard insulators

Lecture: Band theory and Mott insulators: Hubbard U instead of Stoner I

  17.12.2013

Andrey Komendantyan

Report: Materials for batteries prediction with data mining

  26.12.2013

Yuri Fomin

Lecture: Crossover between "rigid" and "soft" fluid in supercritical regime pdf

 

November 2013

 

14.11.2013

Qinggao Wang

Lecture: Тhe multiple roles of an oxygen vacancy in photocatalyst   
Recommend article: Ulrike Diebold, surface science reports 48 (2003), 53-229.

Igor Blinov

Review: Basics of field theory in condensed matter and DFT+U method

  21.11.2013

Haiyang Niu

Lecture: Two Hardness models - Lyakhov-Oganov and Chen-Niu.

  28.11.2013

Valeriy Roizen

Review: methods of cocrystals predition

Igor Blinov

Report: theory and experimental methods in investigations of ferromagnetics

 

 

 

 

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