Center for Molecular Modeling - Prof. Dr. Michel Waroquier

Development of Theoretical Tools to Accurately Determine Spectroscopic Properties Using Advanced Electronic Structure Methods

wim — Tue, 23 Sep 2014 07:46:49 +0000

A. Van Yperen-De Deyne

Tue, 16/09/2014

Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent

http://hdl.handle.net/1854/LU-5707761

Supervisors

Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. ir. Karen Hemelsoet, Prof. Dr. Michel Waroquier

Attachment (private)

PhD-thesis-VanYperenDeDeyne-Andy_revision.pdf

Molecular dynamics simulations as a tool for understanding zeolite nanogrowth and liquid structure

wim — Fri, 18 Oct 2013 11:51:08 +0000

M. Van Houteghem

Mon, 16/12/2013

Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent

http://hdl.handle.net/1854/LU-4228273

Supervisors

Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. Michel Waroquier

Attachment (private)

phd_MarcVanHouteghem_okt.pdf

Bridging the Gap between Experiment and Theory with First-Principles Chemical Kinetics: Unraveling Reaction Pathways within Metal-Organic Frameworks and Zeolites

wim — Thu, 08 Nov 2012 07:24:29 +0000

M. Vandichel

Wed, 07/11/2012

Ghent University AULA, Voldersstraat, Ghent

http://hdl.handle.net/1854/LU-3049777

Studie van de microscopische structuur van koperhoudende zeolieten

wim — Wed, 27 Jun 2012 08:14:30 +0000

S. Versaevel

Master of Science in Engineering Physics

2012

Supervisors

Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. Michel Waroquier

Attachment (private)

Eindwerk.pdf

CLUSTEREXPANSIE EN DE KRISTALSTRUCTUUR VAN IJZERNIKKELLEGERINGEN IN HET MIDDELPUNT VAN DE AARDE EN IN EXOPLANETEN

wim — Mon, 26 Mar 2012 09:27:15 +0000

Academic year

2012-2013

Study programme

M. Toegepaste Natuurkunde

M. Materiaalkunde

M. Fysica

Subject category

Solid-state physics

Referentie

MM_12_MAT_04

Attachment

MM_12_MAT_04.pdf

Promotor(en)

Prof. Dr. Stefaan Cottenier, Prof. Dr. Michel Waroquier

GREENSE FUNCTIE BEREKENINGEN OP ADC(3)-NIVEAU

wim — Mon, 26 Mar 2012 09:18:42 +0000

Academic year

2012-2013

Study programme

M. Toegepaste Natuurkunde

M. Fysica

Subject category

Many-particle physics

Referentie

MM_12_FUND_01

Attachment

MM_12_FUND_01.pdf

Promotor(en)

Prof. Dr. Dimitri Van Neck, Prof. Dr. Michel Waroquier

Ab initio prediction of material properties for the inner core of the planet Mercury

wim — Wed, 01 Feb 2012 08:06:46 +0000

J. Jaeken

Master of Science in Physics and Astronomy

2012

Supervisors

Prof. Dr. Michel Waroquier, Prof. Dr. Stefaan Cottenier

Attachment (private)

JJaeken_D2.pdf

Electrontraps in organische kristallen

wim — Tue, 13 Dec 2011 15:40:42 +0000

Modellering van thermodynamische grootheden en kinetische parameters in periodieke moleculaire systemen

wim — Tue, 13 Dec 2011 15:37:43 +0000

Gecombineerd experimentele-theoretische studie van de stralingschemie van aminozuren

wim — Tue, 13 Dec 2011 15:34:54 +0000

Center for Molecular Modeling - Prof. Dr. Michel Waroquier

Development of Theoretical Tools to Accurately Determine Spectroscopic Properties Using Advanced Electronic Structure Methods

Supervisors

Attachment (private)

Molecular dynamics simulations as a tool for understanding zeolite nanogrowth and liquid structure

Supervisors

Attachment (private)

Bridging the Gap between Experiment and Theory with First-Principles Chemical Kinetics: Unraveling Reaction Pathways within Metal-Organic Frameworks and Zeolites

Supervisors

Attachment (public)

Attachment (private)

Studie van de microscopische structuur van koperhoudende zeolieten

Supervisors

Attachment (private)

CLUSTEREXPANSIE EN DE KRISTALSTRUCTUUR VAN IJZERNIKKELLEGERINGEN IN HET MIDDELPUNT VAN DE AARDE EN IN EXOPLANETEN

Academic year

Study programme

Subject category

Referentie

Attachment

Promotor(en)

GREENSE FUNCTIE BEREKENINGEN OP ADC(3)-NIVEAU

Academic year

Study programme

Subject category

Referentie

Attachment

Promotor(en)

Ab initio prediction of material properties for the inner core of the planet Mercury

Supervisors

Attachment (private)

Electrontraps in organische kristallen

Modellering van thermodynamische grootheden en kinetische parameters in periodieke moleculaire systemen

Gecombineerd experimentele-theoretische studie van de stralingschemie van aminozuren