IOF NANO search menu search content Ab initio and classical simulation and modeling - IOF NANO Ab initio and classical simulation and modelling High-throughput computational screening of materials Ab initio modelling of nanostructures and two-dimensional crystals The electronic properties of (nano)c…

Condensed Matter Theory search menu search content Materials by design We employ ab initio calculations to gain insight into the new or even hypothetical materials. The study of new materials is important for example for the energy aplications, energy storage and solar cells. Our ab initio research …

Kris Van Alsenoy emeritus occasionele opdracht Onderzoek Kris Van Alsenoy Onderzoeksgroep Expertise Berekeningen van moleculaire eigenschappen met kwantumchemische methoden. Ontwikkeling van nieuwe exchange-correlatie functionalen en introduceren van fractionele bezettingen in KS-DFT. 01/10/2009 - 3…

Kris Van Alsenoy emeritus occasional assignment Research Kris Van Alsenoy Research team Expertise Calculation of molecular properties using quantum chemical methods. Development of new exchange-correlation functionals and introduction of fractional occupation numbers in KS-DFT. 01/10/2009 - 30/09/20…

Bart Sorée unpaid guest prof. Research Bart Sorée Research team Condensed Matter Theory Nanostructured topological insulators. 01/10/2014 - 30/09/2016 Abstract The route we propose is by nanostructuring TIs. For example, in this project we study by ab initio density functional theory calculations …

Dirk Lamoen hoogleraar Onderzoek Dirk Lamoen Onderzoeksgroep Elektronenmicroscopie voor materiaalonderzoek (EMAT) Expertise Karakterisatie van structurele, elektronische, optische en magnetische eigenschappen van materialen door middel van "first-principles" (i.e. kwantummechanische) elektronische s…

Bart Partoens hoogleraar Onderzoek Bart Partoens Onderzoeksgroep Theorie van de gecondenseerde materie Expertise Karakterisatie van structurele, elektronische, optische en magnetische eigenschappen van materialen door middel van "first-principles" (i.e. kwantummechanische) elektronische structuurber…

Dirk Lamoen professor Research Dirk Lamoen Research team Electron microscopy for materials research (EMAT) Expertise Characterization of structural, electronic, optical and magnetic properties of materials by means of first-principles (i.e. quantum-mechanical) electronic structure calculations. Char…

M Purushothaman doctoraatsbursaal Onderzoek M Purushothaman Onderzoeksgroep Theorie van de gecondenseerde materie Verbeterde Exciton-levensduur in (computationeel ontworpen) 2D-heterostructuren van transitiemetaaldichalcogeniden. 01/10/2024 - 30/09/2028 Abstract Tweedimensionale transitiemetaaldicha…

Matthew Houtput postdoc mandaat FWO Onderzoek Matthew Houtput Onderzoeksgroep Theorie van kwantumsystemen en complexe systemen Expertise Het grootste deel van mijn onderzoekservaring is in theoretische fysica van de gecondenseerde materie. Ik ben mijn onderzoekscarrière gestart met het theoretisch …

Bart Partoens professor Research Bart Partoens Research team Condensed Matter Theory Expertise Characterization of structural, electronic, optical and magnetic properties of materials by means of first-principles (i.e. quantum-mechanical) electronic structure calculations. Characterization of the ef…

M Purushothaman doctoral scholarship holder Research M Purushothaman Research team Condensed Matter Theory Enhanced Exciton Lifetime in (computationally designed) 2D Heterostructures of Transition Metal Dichalcogenides. 01/10/2024 - 30/09/2028 Abstract Two-dimensional transition metal dichalcogenide…

Bart Sorée onbezoldigd gastprofessor Onderzoek Bart Sorée Onderzoeksgroep Theorie van de gecondenseerde materie Nanogestructureerde topologische insulatoren. 01/10/2014 - 30/09/2016 Abstract Dit project betreft fundamenteel kennisgrensverleggend onderzoek gefinancierd door het Fonds voor Wetenscha…

Condensed Matter Theory search menu search content Doctoral theses PhD theses completed in our research group List of completed PhD theses in chronological order (downloads available). Sofia Magalhães Cunha (11 Jan 2022) Wave-packet dynamics and electronic transport properties in 2D materials Alvar…

Cem Sevik hoofddocent - senior onderzoeker Onderzoek Cem Sevik Onderzoeksgroep Theorie van de gecondenseerde materie Expertise Cem Sevik is een expert op het gebied van computationele gecondenseerde materie en materiaalwetenschap. Hij heeft meer dan 15 jaar uitgebreide ervaring in de karakterisering…

IOF NANO search menu search content Members Members Each research group within the NANOcenter consortium has its own albeit complementary expertise covering the fields of advanced nanoscale characterization, ab initio and classical simulation and modeling of various nanomaterials. Research Group Sen…

Pieter Billen hoofddocent Mijn website Pieter Billen Welcome Welcome! I am assistant professor at the Faculty of Applied Engineering, teaching at the Chemistry/Biochemistry department, and am a member (spokesperson) of the research group iPRACS (Intelligence in Processes, Advanced Catalysts & Solven…

Matthew Houtput postdoc researcher FWO Research Matthew Houtput Research team Theory of quantum systems and complex systems Expertise Most of my research experience is in the field of theoretical condensed matter physics. I have started my research career by theoretically modelling a high-pressure e…

Cem Sevik associate professor - senior researcher Research Cem Sevik Research team Condensed Matter Theory Expertise I am a computational condensed matter and material science expert. I have more than 15 years of extensive experience in the characterization of electronic, optical, thermal, thermoele…

Rolando Saniz Balderrama retired BAP with assignment Research Rolando Saniz Balderrama Research team Electron microscopy for materials research (EMAT) Expertise Theoretical modeling of materials, focusing on their structural and electronic characteristics in order to determine and understand their o…

Karl Michel emeritus occasionele opdracht Publicaties Karl Michel Phonon hydrodynamics, thermal conductivity, and second sound in two-dimensional crystals Bron Physical review B - ISSN 2469-9950-99:14 (2019) p. Auteur(s) Pablo Martin Scuracchio, Karl H. Michel, François Peeters Citatielink Sound wa…

Ine Arts senior onderzoeker Publicaties Ine Arts Ab initio study of the adsorption of O, O₂, H₂O and H₂O₂ on UO₂ surfaces using DFT plus U and non-collinear magnetism Bron Journal of nuclear materials - ISSN 0022-3115-599 (2024) p. 1-12 Auteur(s) Ine Arts, Rolando Saniz, Gianguido Baldinoz…

Rolando Saniz Balderrama gepensioneerd BAP met opdracht Publicaties Rolando Saniz Balderrama Ab initio study of the adsorption of O, O₂, H₂O and H₂O₂ on UO₂ surfaces using DFT plus U and non-collinear magnetism Bron Journal of nuclear materials - ISSN 0022-3115-599 (2024) p. 1-12 Auteur(s)…

Karl Michel emeritus occasional assignment Publications Karl Michel Phonon hydrodynamics, thermal conductivity, and second sound in two-dimensional crystals Source Physical review B - ISSN 2469-9950-99:14 (2019) p. Author(s) Pablo Martin Scuracchio, Karl H. Michel, François Peeters Citation link So…

Frank Blockhuys hoofddocent Publicaties Frank Blockhuys Quantum chemical mass spectrometry : verification and extension of the mobile proton model for histidine Bron Journal of the American Society for Mass Spectrometry - ISSN 1044-0305-28:6 (2017) p. 1227-1235 Auteur(s) Julie Cautereels, Frank Bloc…