Dimitri Van Neck

Full professor (WE05)
+32 (0)9 264 65 57
​​​​​Tech Lane Ghent Science Park, Campus Ardoyen
Technologiepark 46, 9052 Zwijnaarde, Belgium
Office n°018

A1 publications

Non CMM publications (A1)

Correlation effects in single-particle overlap functions and one-nucleon removal reactions , M.K. Gaidarov, K.A. Pavlova, S.S. Dimitrova, M.V. Stoitsov, A.N. Antonov, D. Van Neck, H. Müther , Physical Review C , 60 (2), 024312 , 1999
Relationships between two-particle overlap functions and the two-body density matrix for many-fermion systems , A.N. Antonov, S.S. Dimitrova, M.V. Stoitsov, D. Van Neck, P. Jeleva , Physical Review C , 59 (2), 722-725 , 1999
Radiative proton-deuteron capture in a gauge invariant relativistic model , A.Y. Korchin, D. Van Neck, O. Scholten, M. Waroquier , Physical Review C , 59 (4), 1890-1905 , 1999
Production of e+ e− pairs in proton-deuteron capture to 3He , A.Y. Korchin, D. Van Neck, M. Waroquier, O. Scholten, A.E.L. Dieperink , Physics Letters B , 441 (1-4), 17-26 , 1998
Investigation of the 10B(γ,p) reaction using tagged photons , L.J. de Bever, D. Branford, J.-O. Adler, B.-E. Andersson, I. Bobeldijk, T. Davinson, R.S. Hicks, D.G. Ireland, K. Livingston, R.L.J. van der Meer, R.A. Miskimen, D. Van Neck, L. Isaksson, R.D. Page, G.A. Peterson, J. Rahighi, H. Ruijter, B. Schröder, G. van der Steenhoven, P.J. Woods, K. Wang, A.C. Schotter , Physical Review C , 58 (2), 981-986 , 1998
Single-particle properties in self-bound systems , D. Van Neck, M. Waroquier , Physical Review C , 58 (6), 3359-3367 , 1998
Center-of-mass effects on the quasihole spectroscopic factors in the 16O(e,e′p) reaction , D. Van Neck, M. Waroquier, A.E.L. Dieperink, S.C. Pieper, V.R. Pandharipande , Physical Review C , 57 (5), 2308-2315 , 1998
Radial Dependence of the Nucleon Effective Mass in 10B , L.J. de Bever, H.P. Blok, R.S. Hicks, C.W. De Jager, N. Kalantar-Nayestanaki, J.J. Kelly, L. Lapikás, R.A. Miskimen, D. Van Neck, G.A. Peterson, G. van der Steenhoven, H. De Vries , Physical Review Letters , 80 (18), 3924-3927 , 1998
Nuclear overlap functions determined by the asymptotic behavior of the one-body density matrix , D. Van Neck, L. Van Daele, Y. Dewulf, M. Waroquier , Physical Review C , 56 (3), 1398-1409 , 1997
Nucleon-nucleon correlations and the Coulomb Displacement Energy , D. Van Neck, M. Waroquier, K. Heyde , Heavy Ion Physics , 6 (1-4), 29-36 , 1997
Photon-induced proton knockout from 208Pb and 12C , E.C. Aschenauer, C. Van den Abeele, J.-O. Adler, B.-E. Andersson, L.J. de Bever, I. Bobeldijk, D. Branford, S.A. Bulychjov, T. Davinson, K. Hansen, D.G. Ireland, L. Isaksson, D. Ivanov, D.G. Johnstone, A. Khanov, L. Lapikás, R.A. Lindgren, G. De Meyer, D. Van Neck, B. Nilsson, H. Ruijter, D. Ryckbosch, A. Sandell, A.C. Shotter, B. Schröder, V. Van der Sluys, G. van der Steenhoven, P. Svensson, M.A. van Uden, R.E. Van de Vyver , Nuclear Physics A , 615 (1), 33-51 , 1997
Long-range correlations in finite nuclei: comparison of two self-consistent treatments , Y. Dewulf, D. Van Neck, L. Van Daele, M. Waroquier , Physics Letters B , 396, 7-14 , 1997
Natural orbitals, overlap functions, and mean-field orbitals in an exactly solvable A-body system , D. Van Neck, A.E.L. Dieperink, M. Waroquier , Physical Review C , 53 (5), 2231-2242 , 1996
Pion and photon induced reactions on the nucleon in a unitary model , O. Scholten, A.Y. Korchin, V. Pascalutsa, D. Van Neck , Physics Letters B , 384 (1-4), 13-19 , 1996
Single-particle properties in an exactly solvable $A$-body system , D. Van Neck, A.E.L. Dieperink, M. Waroquier , Zeitschrift für Physik , 355 (2), 107-109 , 1996
The mass-dependence of meson-exchange currents in the reaction (gamma,p) , E.C. Aschenauer, I. Bobeldijk, D.G. Ireland, L. Lapikás, D. Van Neck, B. Schröder, V. Van der Sluys, G. van der Steenhoven, R.E. Van de Vyver , Physics Letters B , 389 (3), 470-474 , 1996
Low-energy theorems for virtual nucleon-nucleon bremssrahlung; formalism and results , A.Y. Korchin, O. Scholten, D. Van Neck , Nuclear Physics A , 602 (3-4), 423-448 , 1996
Spectral function for finite nuclei in the local-density approximation , D. Van Neck, A.E.L. Dieperink, E. Moya de Guerra , Physical Review C , 51 (4), 1800-1808 , 1995
Dilepton production from virtual bremsstrahlung induced by proton capture , D. Van Neck, A.E.L. Dieperink, O. Scholten , Nuclear Physics A , 574 (4), 643-658 , 1994
Proton hole states in 208Pb, studied by means of a self-consistent solution of the second-order Dyson equation for single-particle propagators , D. Van Neck, M. Waroquier, V. Van der Sluys, K. Heyde , Nuclear Physics A , 563 (1), 1-20 , 1993
Fragmentation of single-particle strength in spherical open-shell nuclei: Application to the spectral functions in 142Nd , V. Van der Sluys, D. Van Neck, M. Waroquier, J. Ryckebusch , Nuclear Physics A , 551 (2), 210-240 , 1993
Occupation numbers in a shell-model approach , D. Van Neck, M. Waroquier, V. Van der Sluys, J. Ryckebusch , Physics Letters B , 274 (2), 143-148 , 1992
Electron-induced proton knock-out from 30Si, 31P and 32S , J. Wesseling, C.W. De Jager, L. Lapikás, H. De Vries, M.N. Harakeh, N. Kalantar-Nayestanaki, L.W. Fagg, R.A. Lindgren, D. Van Neck , Nuclear Physics A , 547 (3), 519-541 , 1992
Proton spectral functions for the hole states in 89Y using a self-consistent microscopic formalism , D. Van Neck, M. Waroquier, J. Ryckebusch , Physics Letters B , 249 (2), 157-162 , 1990
(e, e' p) study of the continuum of 58Ni above the giant resonance re , K. Reiner, P. Grabmayr, G. Mauser, G. Mertens, G.J. Wagner, J. Friedrich, N. Voegler, K.T. Knöpfle, J. Ryckebusch, K. Heyde, D. Van Neck, M. Waroquier , Physics Letters B , 228 (1), 31-36 , 1989
Quasi-elastic 16O(e, e′ p) cross sections in a self-consistent microscopic model , J. Ryckebusch, K. Heyde, D. Van Neck, M. Waroquier , Physics Letters B , 216 (3-4), 252-256 , 1989
Aspects of the final-state interaction and long-range correlations in quasi-elastic (e, e′p) and (e, e′n) reactions , J. Ryckebusch, K. Heyde, D. Van Neck, M. Waroquier , Nuclear Physics A , 503 (3-4), 694-722 , 1989
On the separation between the longitudinal and transverse strength in quasi-elastic (e, e′p) reactions , J. Ryckebusch, K. Heyde, D. Van Neck, M. Waroquier , Physics Letters B , 222 (2), 183-187 , 1989
Coincidence 58Ni(e, e′pi) cross sections at moderate energy and momentum transfer , J. Ryckebusch, K. Heyde, D. Van Neck, M. Waroquier , Nuclear Physics A , 505 (3-4), 755-778 , 1989

A2 publications

2006

Nuclear equation of state and the structure of neutron stars , A.E.L. Dieperink, D. Van Neck, Y. Dewulf, V. Rodin , Nato Science series: Superdense QCD Matter and Compact Stars , 20 (1), 1742-6588 | ISSN 1742-6588 (Print) ISSN 1742-6596 (Online) , 2006

B publications

P1 publications

Talks

Posters

2003

Influence of variable moments of inertia in internal rotations in butane, pentane and hexane , P. Vansteenkiste, D. Van Neck, V. Van Speybroeck, M. Waroquier , DFT2003 conference: "The applications of Density Functional Theory in Chemistry and Physics , Brussels, Belgium , Sun, 07/09/2003 to Fri, 12/09/2003

2002

Role of coupling of internal and external rotations on the ab initio determination of entropy and heat capacity of gas-phase alkanes , P. Vansteenkiste, V. Van Speybroeck, D. Van Neck, M. Waroquier , EUCO-CC4, 4th European Conference on Computational Chemistry , Assisi, Italy , Sun, 01/09/2002 to Fri, 06/09/2002

2001

Self-consistent solution of Dyson's equation up to second order: closed and open shell atoms , K. Peirs, D. Van Neck, M. Waroquier , 9th International Conference on the Applications of the Density Functional Theory in Chemistry and Physics , Madrid, Spain , Mon, 10/09/2001 to Fri, 14/09/2001
Compton scattering on the proton and light nuclei in the delta-resonance region , O. Scholten, S. Kondratyuk, L. Van Daele, D. Van Neck, M. Waroquier, A.Y. Korchin , TAPS Workshop VI , Kryze, Poland , Sun, 09/09/2001 to Thu, 13/09/2001
Short-range correlations in nuclear matter using Green's functions within a discrete pole approximation , Y. Dewulf, D. Van Neck, M. Waroquier , The International Conference in Many-Body Theories , Manchester, UK , Mon, 09/07/2001 to Fri, 13/07/2001
Compton scattering on the proton and light nuclei in the delta-resonance region , L. Van Daele, S. Kondratyuk, A.Y. Korchin, D. Van Neck, O. Scholten, M. Waroquier , Fifth Workshop on Electromagnetically Induced Two-Hadron Emission , Lund, Sweden , Wed, 13/06/2001 to Sat, 16/06/2001

2000

Study of elementary reactions in the thermal cracking process , V. Van Speybroeck, D. Van Neck, M. Waroquier, S. Wauters, M. Saeys, G.B. Marin , Doctoral Symposium , Ghent Univeristy, Faculty of Engineering, Ghent, Belgium , Tue, 05/12/2000
Solution of the Dyson equatios in atomic systems , K. Peirs, D. Van Neck, M. Waroquier , DFT2000: Satellite Symposium of the 10th international Congress of Quantum Chemistry , Menton, France , Wed, 14/06/2000
Study of elementary reactions in the termal cracking process , V. Van Speybroeck, D. Van Neck, M. Waroquier, S. Wauters, M. Saeys, G.B. Marin , DFT2000: Satellite Symposium of the 10th international Congress of Quantum Chemistry , Menton, France , Sun, 11/06/2000 to Wed, 14/06/2000

2006

Many-Body Theory Exposed! Propagator Description of Quantum Mechanics in Many-Body Systems , W.H. Dickhoff, D. Van Neck , World Scientific Publishing Company , ISBN 978-9812813794 , 2006

2017

Invited talk
Richardson-Gaudin models and topological superconductivity , P. Claeys, S. De Baerdemacker, D. Van Neck , Q-Top: Quantum and Topological Matter meeting , Leiden University, The Netherlands , Fri, 03/02/2017

2016

Read-Green resonances in an integrable superconductor coupled to a bath , P. Claeys, S. De Baerdemacker, D. Van Neck , XXIVth International Conference on Integrable Systems and Quantum symmetries (ISQS-24) , Prague, Czech Republic , Tue, 14/06/2016 to Sat, 18/06/2016
When two is better than one: the seniority scheme as a new tool to build wave functions , S. De Baerdemacker, P. Claeys, W. Poelmans, D. Van Neck, P. Bultinck, M. Van Raemdonck, P.W. Ayers, P.A. Limacher, P.A. Johnson, K. Boguslawski, P. Tecmer , QCB12 , Leuven, Belgium , Tue, 16/02/2016

2015

Computational insight into the polymerization of conjugated electroluminescent polymer PPV: Diradical character of monomers and dimers , J. Durdevic, S. Wouters, J. Romanova, A. Shimizu, B. Champagne, T. Junkers, D. Vanderzande, D. Van Neck, M. Waroquier, V. Van Speybroeck, S. Catak , 250th ACS National Meeting & Exposition - Division of Catalysis Science and Technology (CATL) , Boston, MA, USA , Sun, 16/08/2015 to Thu, 20/08/2015
Integrable Dicke and Jaynes-Cummings models, and extensions , S. De Baerdemacker, P. Claeys, D. Van Neck , XXXth International Colloquium on Group Theoretical Methods in Physics , Ghent, Belgium , 27 , Tue, 14/07/2015 to Sat, 18/07/2015

2014

A mechanistic investigation of the manganese-salen epoxidation , T. Bogaerts, A. Van Yperen-De Deyne, S. Wouters, D. Van Neck, P. Van der Voort, V. Van Speybroeck , 15th International Conference on Theoretical Aspects of Catalysis (ICTAC15) , London, United Kingdom , Mon, 30/06/2014 to Fri, 04/07/2014
Unraveling the mechanism of the manganese-salen epoxidation , T. Bogaerts, A. Van Yperen-De Deyne, S. Wouters, D. Van Neck, P. Van der Voort, V. Van Speybroeck , XVth Netherlands' Catalysis and Chemistry Conference (NCCC XV) , Noordwijkerhout, The Netherlands , Mon, 10/03/2014 to Wed, 12/03/2014

2013

Ab initio study of synergetic effects of Mn and Si in the interaction with point defects in BCC Fe , A. Bakaev, D. Terentyev, D. Van Neck , 5th Workshop on Nuclear Fe Alloys (n-FAME) , Rome, Italy , Thu, 28/11/2013 to Fri, 29/11/2013
Richardson-Gaudin Integrable Systems (and Beyond) for Strongly Correlated Quantum Many-Body Systems , S. De Baerdemacker, P.W. Ayers, P. Bultinck, P.A. Johnson, P.A. Limacher, D. Van Neck, M. Van Raemdonck , MQM 2013 , Lugano, Switzerland , Sun, 02/06/2013 to Fri, 07/06/2013

2012

Variational optimization of second order density matrices: the past, the present and the future , H. van Aggelen, B. Verstichel, P. Bultinck, D. Van Neck, P.W. Ayers , DFTM2012 , Ghent Univeristy, Het Pand, Ghent, Belgium , O10 , Sun, 01/04/2012 to Fri, 06/04/2012

2010

Efficient calculation of QM/MM frequencies with the Mobile Block Hessian method , A. Ghysels, H. Lee Woodcock III, Y. Shao, J. Kong, B.R. Brooks, D. Van Neck, V. Van Speybroeck, M. Waroquier , North American Meeting on Industrial and Applied Mathematics (NAMIAM) , Huatulco, Mexico , Mon, 06/12/2010 to Sat, 11/12/2010
Electron penetration into the nucleus and its effect on the quadrupole interaction , K. Koch, K. Koepernik, D. Van Neck, S. Cottenier , 3rd Joint International Conference on Hyperfine Interactions and International Symposium on Nuclear Quadrupole Interactions , CERN, Geneva, Switzerland , Mon, 13/09/2010 to Fri, 17/09/2010

2009

Normal mode analysis of macromolecular systems with the Mobile Block Hessian method , A. Ghysels, V. Van Speybroeck, D. Van Neck, B.R. Brooks, M. Waroquier , International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2009) , Rhodos, Greece
4 pages
Tue, 29/09/2009 to Sun, 04/10/2009
Variational Reduced Density Matrix Theory: Successes and Failures , P.W. Ayers, D. Van Neck, P. Bultinck, H. van Aggelen, B. Verstichel , Seventh Canadian Computational Chemistry Conference (CCCC7) , Dalhousie, Canada , Mon, 20/07/2009 to Fri, 24/07/2009
Dissociation curves from variational second order density matrices: an Atoms in Molecules perspective , P. Bultinck, H. van Aggelen, B. Verstichel, D. Van Neck, P.W. Ayers , 92nd Canadian Chemistry Conference , Hamilton, Canada , Sat, 30/05/2009 to Fri, 05/06/2009

2007

New force-field models for biporous zeolites with guest molecules , T. Verstraelen, P.W. Ayers, D. Van Neck, V. Van Speybroeck, M. Waroquier , Advanced micro- and mesoporous materials , Varna, Bulgaria , Thu, 06/09/2007 to Sun, 09/09/2007
New methods in force-field development , T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier , VIIth Netherlands' Catalysis and Chemistry Conference (NCCC VII) , Noordwijkerhout, The Netherlands , Mon, 05/03/2007 to Wed, 07/03/2007

2006

New developments in the parameterization of force fields based on ab initio training data , T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier , CECAM Workshop: Computational aspects of building blocks, nucleation, and synthesis of porous materials , Lyon, France , Mon, 28/08/2006 to Thu, 31/08/2006
Density functional theory for quasiparticle properties , D. Van Neck , 25th International Workshop on Nuclear Theory , Rila Mountain (Govedartze), Bulgaria , Mon, 26/06/2006 to Sat, 01/07/2006

2003

Nuclear matter, neutron matter, symmetry energy: Green's function calculation versus hole-line expansions (Invited) , D. Van Neck , ECT-meeting 'Short- and long-range contributions to nuclear binding and saturation' , Trento, Italy , Mon, 02/06/2003 to Sat, 07/06/2003

2002

Kinetics of 1-hexene isomerization with methane sulphonic acid from first principles , V. Van Speybroeck, D. Van Neck, M. Waroquier , Eurokin meeting , Terneuzen, The Netherlands , Mon, 25/11/2002
Microscopic Study of exchange-correlation functionals in DFT by using Green's function perturbation techniques , K. Peirs, D. Van Neck, M. Waroquier , 223rd ACS National Meeting , Orlando, Florida, US , Sun, 07/04/2002 to Thu, 11/04/2002

2018

Tree tensor networks in ab initio quantum chemistry , K. Gunst, F. Verstraete, S. Wouters, Ö. Legeza, D. Van Neck , Numerical Methods in Strongly Correlated Quantum Systems , Marburg, Germany , Mon, 19/02/2018 to Fri, 23/02/2018

2017

Correlation functions and inner products in integrable Richardson-Gaudin models , P. Claeys, D. Van Neck, S. De Baerdemacker , Correlation functions of quantum integrable systems and beyond , Lyon, France , Mon, 23/10/2017 to Thu, 26/10/2017
Making 2-electron response reduced density matrices N-representable , C. Lanssens, P.W. Ayers, D. Van Neck, S. De Baerdemacker, K. Gunst, P. Bultinck , International Summer School in Electronic Structure Theory: Electron Correlation in Physics and Chemistry , Aussois, France , Sun, 18/06/2017 to Sat, 01/07/2017

2016

Making 2-electron response reduced density matrices N-representable , C. Lanssens, P.W. Ayers, P. Bultinck, D. Van Neck , Summer School Modern Wavefunction Methods in Electronic Structure Theory , Gelsenkirchen, Germany , Mon, 03/10/2016 to Sat, 08/10/2016
Read-Green resonances in an integrable superconductor coupled to a bath , P. Claeys, S. De Baerdemacker, D. Van Neck , ISQS-24 , Prague, Czech Republic , Tue, 14/06/2016 to Sat, 18/06/2016
Read‐Green resonances in a topological superconductor coupled to a bath , P. Claeys, S. De Baerdemacker, D. Van Neck , General Scientific Meeting 2016 of the Belgian Physical Society , Ghent, Belgium , Wed, 18/05/2016

2014

Exploring the phase diagram of the p_x + ip_y pairing Hamiltonian by linking the eigenstates to associated bosonic states. , M. Van Raemdonck, S. De Baerdemacker, D. Van Neck , 30th International Colloquium on Group Theoretical Methods in Physics , Ghent, Belgium , Mon, 14/07/2014 to Fri, 18/07/2014
Synergy of interaction between point defects, carbon and typical alloying elements of Fe-based steels , A. Bakaev, D. Terentyev, D. Van Neck , COSIRES 2014: Computer Simulation of Radiation Effects in Solids , Alicante, Spain , Sun, 08/06/2014 to Fri, 13/06/2014
DMRG-SCF study of the singlet, triplet, and quintet states of oxo-Mn(Salen) , S. Wouters, T. Bogaerts, P. Van der Voort, V. Van Speybroeck, D. Van Neck , Low-scaling and Unconventional Electronic Structure Techniques Conference , Telluride, CO, USA , Sun, 01/06/2014 to Thu, 05/06/2014
Projector quantum Monte Carlo with matrix product states , B. Verstichel, S. Wouters, D. Van Neck, G. K.-L. Chan , Low-scaling and Unconventional Electronic Structure Techniques Conference , Telluride, CO, USA , Sun, 01/06/2014 to Thu, 05/06/2014
Synergetic effects of Mn and Si in the interaction with point defects in bcc Fe , A. Bakaev, D. Terentyev, D. Van Neck , International Conference: Towards Reality in Nanoscale Materials VII , Levi, Finland , Mon, 10/02/2014 to Wed, 12/02/2014

2013

Interpreting the phase diagram of the p_x + ip_y pairing Hamiltonian by deforming the pairing algebra. , M. Van Raemdonck, S. De Baerdemacker, D. Van Neck , The "March" meeting , Namur, Belgium , Thu, 21/11/2013 to Sat, 23/11/2013
Reduced Density Matrix Optimization for the Two-Dimensional Hubbard Model , B. Verstichel, W. Poelmans, S. Wouters, S. De Baerdemacker, D. Van Neck , MQM 2013 , Lugano, Switzerland , Sun, 02/06/2013 to Fri, 07/06/2013
Variational Determination of the Two-Particle Reduced Density Matrix on the GPU , W. Poelmans, B. Verstichel, D. Van Neck, P. Bultinck , MQM 2013 , Lugano, Switzerland , Sun, 02/06/2013 to Fri, 07/06/2013

2012

Perturbations on the superconducting state of metallic nanoparticles: a canonical Richardson-Gaudin approach , M. Van Raemdonck, S. De Baerdemacker, D. Van Neck , International symposium on small particles and inorganic clusters XVI , Leuven Belgium , Sun, 08/07/2012 to Fri, 13/07/2012
Longitudinal static optical properties of hydrogen chains: finite field extrapolations of matrix product state calculations , S. Wouters, P. A. Limacher, D. Van Neck, P.W. Ayers , Networking Tensor Networks: Many-Body Systems and Simulations , Benasque, Spain , Mon, 07/05/2012 to Fri, 18/05/2012
A Khon-Sham-like model for the l-body reduced density matrix from a strongly-correlated reference , P.A. Johnson, P.W. Ayers, S. De Baerdemacker, D. Van Neck, P. Bultinck , DFTM2012 , Ghent University, Het Pand, Ghent, Belgium , Sun, 01/04/2012 to Fri, 06/04/2012
Three particles constraint as linear inequalities in v2DM optimization , W. Poelmans, B. Verstichel, D. Van Neck , DFTM2012 , Ghent University, Het Pand, Ghent, Belgium , Sun, 01/04/2012 to Fri, 06/04/2012
Variational density study of the one-dimensional Hubbard model: the need for three-particle constraints , B. Verstichel, H. van Aggelen, W. Poelmans, D. Van Neck , DFTM2012 , Ghent University, Het Pand, Ghent, Belgium , Sun, 01/04/2012 to Fri, 06/04/2012

2011

Plastic deformation of Fe-Ni-Cr alloys under irradiation: atomic-level study , A. Bakaev, D. Van Neck, G. Van Oost, D. Terentyev , Day of the PhD's 2011, SCK-CEN , Mol, Belgium , Thu, 06/10/2011
Faddeev Random Phase Approximation for Molecules , M. Degroote, D. Van Neck, C. Barbieri , ISTCP-VII , Waseda, Japan , Fri, 02/09/2011 to Sat, 08/10/2011

2010

Insight into zeolite nanogrowth through the analysis of vibrational spectra in terms of internal coordinates , M. Van Houteghem, T. Verstraelen, D. Van Neck, C. Kirschhock, J.A. Martens, M. Waroquier , FirW PhD symposium 2010 , Ghent Univeristy, Faculty of Engineering, Ghent, Belgium , Wed, 01/12/2010
Electron penetration into the nucleus and its effect on the quadrupole interaction , K. Koch, H. Rosner, K. Koepernik, D. Van Neck, S. Cottenier , Psi-k Conference , Berlin, Germany , Sun, 12/09/2010 to Thu, 16/09/2010
A new challenge to molecular spectroscopy: The quadrupole shift as a second order correction to the isomer shift , K. Koch, H. Rosner, D. Van Neck, K. Koepernik, S. Cottenier , High Resolution Molecular Spectroscopy 2009 , Castellamare di Stabia, Italy , Tue, 31/08/2010 to Sat, 04/09/2010
Efficient calculation of QM/MM frequencies with the Mobile Block Hessian , A. Ghysels, H. Lee Woodcock III, Y. Shao, B.R. Brooks, D. Van Neck, V. Van Speybroeck, M. Waroquier , Gordon Research Conference - Computational Chemistry , Les Diablerets, Switzerland , Sun, 29/08/2010 to Fri, 03/09/2010
Ab initio calculations on the enthalpy of formation in the FeCr-system , K. Rijpstra, S. Cottenier, V. Van Speybroeck, D. Van Neck , CAMD Summer School 2010 , Lyngby, Denmark , Sat, 14/08/2010 to Fri, 20/08/2010
Normal mode calculations with the QM/MM full Hessian and the Mobile Block Hessian (MBH) method , A. Ghysels, H. Lee Woodcock III, Y. Shao, B.R. Brooks, V. Van Speybroeck, D. Van Neck, M. Waroquier , Quantum Chemistry in Belgium 9th edition , Louvain-la-Neuve, Belgium , Tue, 26/01/2010

2009

Chemical implications of variational second-order density matrix theory: study of diatomic molecules along the potential energy curve , H. van Aggelen, B. Verstichel, P.W. Ayers, P. Bultinck, D.L. Cooper, D. Van Neck , Workshop on Quantum Marginals and Density Matrices , Toronto, Canada , Mon, 27/07/2009 to Fri, 31/07/2009
Normal mode calculations with the QM/MM full Hessian and the Mobile Block Hessian (MBH) method , A. Ghysels, H. Lee Woodcock III, Y. Shao, B.R. Brooks, V. Van Speybroeck, D. Van Neck, M. Waroquier , 7th Canadian Computational Chemistry Conference , Halifax, Canada , Mon, 20/07/2009 to Fri, 24/07/2009
An efficient approach for the calculation of frequencies in macromolecules , A. Ghysels, V. Van Speybroeck, D. Van Neck, B.R. Brooks, M. Waroquier , MolSim 2009 course , Universiteit Amsterdam, The Netherlands , Mon, 05/01/2009 to Fri, 16/01/2009

2008

Normal modes in partially optimized molecular systems , A. Ghysels, V. Van Speybroeck, D. Van Neck, B.R. Brooks, M. Waroquier , SimBioMa 2008 , Konstanz, Germany , Wed, 02/04/2008 to Sat, 05/04/2008

2007

Normal modes in partially optimized molecular systems , A. Ghysels, D. Van Neck, V. Van Speybroeck, T. Verstraelen, M. Waroquier , Doctoral Symposium , Ghent Univeristy, Faculty of Engineering, Ghent, Belgium , Wed, 05/12/2007
Normal modes in partially optimized molecular systems , A. Ghysels, D. Van Neck, V. Van Speybroeck, T. Verstraelen, M. Waroquier , Molecular Quantum Mechanics Conference , Budapest, Hungary , Tue, 29/05/2007 to Sun, 03/06/2007

2006

The Gradient Curves Method: An improved strategy for the derivation of molecular mechanics valence force fields from ab initio data , T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier , 11th International Conference on Theoretical Aspects of Catalysis , Berlin, Germany , Sun, 11/06/2006 to Wed, 14/06/2006

2005

An extended hindered rotor model involving Coriolis and vibrational-rotational coupling , P. Vansteenkiste, D. Van Neck, V. Van Speybroeck, M. Waroquier , DFT2005 , Geneva, Switzerland , Sun, 11/09/2005 to Thu, 15/09/2005
Coupling of electrons to RPA excitations in atoms , S. Verdonck, D. Van Neck, V. Van Speybroeck, M. Waroquier , DFT2005 , Geneva, Switzerland , Sun, 11/09/2005 to Thu, 15/09/2005
A new class of density functionals, based on the energy-dependence of the electronic self-energy , D. Van Neck, V. Van Speybroeck, M. Waroquier , DFT2005 , Geneva, Switzerland , Sun, 11/09/2005 to Thu, 15/09/2005

2015

Normal mode analysis of macromolecular systems with the mobile block Hessian method , A. Ghysels, V. Van Speybroeck, D. Van Neck, B.R. Brooks, M. Waroquier , AIP Conference Proceedings , 1642 (2015), 559 , 2015
The Dicke model as the contraction limit of a pseudo-deformed Richardson-Gaudin model , P. Claeys, S. De Baerdemacker, M. Van Raemdonck, D. Van Neck , Journal of Physics Conference Series , 597, UNSP 012025 , 2015

2014

Probing pairing correlations in Sn isotopes using Richardson-Gaudin integrability , S. De Baerdemacker, V. Hellemans, R. van den Berg, J.-S. Caux, K. Heyde, M. Van Raemdonck, D. Van Neck, P.A. Johnson, A. Buekenhoudt , Journal of Physics: Conference series , 533, 012058 , 2014

2006

The Gradient Curves Method: An improved strategy for the derivation of molecular mechanics valence force fields from ab initio data , T. Verstraelen, D. Van Neck, P.W. Ayers, V. Van Speybroeck, M. Waroquier , LECTURE SERIES ON COMPUTER AND COMPUTATIONAL SCIENCES , Volume: 7A-B, pp. 576-579 , 2006