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ANTON KOKALJ

Senior research associate
Physical and Organic Chemistry
Jozef Stefan Institute
Slovenia

Academician Chemistry
Biography

"Dr. ANTON KOKALJ Ph. D. in Chemistry (2000), University of Ljubljana, Slovenia. His awards are 2003 – The Jozef Stefan Golden Emblem Prize Award 2012 – Pregl Award for important scientific achievements."

Research Intrest

Computational chemistry, Implementation of computer graphics algorithms aimed at first-principles modeling, Development of interfaces for simulation software (interfaces for Quantum-ESPRESSO)

List of Publications
Kokalj A, Dominko R, Mali G, Meden A, Gaberscek M, Jamnik J. Beyond One-Electron Reaction in Li Cathode Materials: Designing Li2Mn x Fe1-x SiO4. Chemistry of Materials. 2007 Jul 24;19(15):3633-40.
Kokalj A. XCrySDen—a new program for displaying crystalline structures and electron densities. Journal of Molecular Graphics and Modelling. 1999 Aug 31;17(3):176-9.
Kokalj A. Computer graphics and graphical user interfaces as tools in simulations of matter at the atomic scale. Computational Materials Science. 2003 Oct 31;28(2):155-68.
Giannozzi P, Baroni S, Bonini N, Calandra M, Car R, Cavazzoni C, Ceresoli D, Chiarotti GL, Cococcioni M, Dabo I, Dal Corso A. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of physics: Condensed matter. 2009 Sep 1;21(39):395502.

Global Scientific Words in Chemistry

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