Dimitri Van Neck

According to our database, Dimitri Van Neck authored at least 9 papers between 2010 and 2022.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2022

Uncovering Clar's aromatic -sextet rule in the Hubbard model using Maximum Probability Domain Partitions.

Daria Tolstykh, Laurent Lemmens, Stijn De Baerdemacker, Dimitri Van Neck, Patrick Bultinck, Guillaume Acke

J. Comput. Chem., 2022

2015

CheMPS2: Improved DMRG-SCF routine and correlation functions.

Sebastian Wouters, Ward Poelmans, Stijn De Baerdemacker, Paul W. Ayers, Dimitri Van Neck

Comput. Phys. Commun., 2015

2014

CheMPS2: A free open-source spin-adapted implementation of the density matrix renormalization group for ab initio quantum chemistry.

Sebastian Wouters, Ward Poelmans, Paul W. Ayers, Dimitri Van Neck

Comput. Phys. Commun., 2014

2011

Fast density matrix-based partitioning of the energy over the atoms in a molecule consistent with the hirshfeld-I partitioning of the electron density.

Diederik Vanfleteren, Dieter Ghillemijn, Dimitri Van Neck, Patrick Bultinck, Michel Waroquier, Paul W. Ayers

J. Comput. Chem., 2011

A self-consistent Hirshfeld method for the atom in the molecule based on minimization of information loss.

Dieter Ghillemijn, Patrick Bultinck, Dimitri Van Neck, Paul W. Ayers

J. Comput. Chem., 2011

A primal-dual semidefinite programming algorithm tailored to the variational determination of the two-body density matrix.

Brecht Verstichel, Helen van Aggelen, Dimitri Van Neck, Patrick Bultinck, Stijn De Baerdemacker

Comput. Phys. Commun., 2011

Variational density matrix optimization using semidefinite programming.

Brecht Verstichel, Helen van Aggelen, Dimitri Van Neck, Paul W. Ayers, Patrick Bultinck

Comput. Phys. Commun., 2011

Faddeev Random Phase Approximation for molecules.

Matthias Degroote, Dimitri Van Neck, Carlo Barbieri

Comput. Phys. Commun., 2011

2010

Comparative study of various normal mode analysis techniques based on partial Hessians.

An Ghysels, Veronique Van Speybroeck, Ewald Pauwels, Saron Catak, Bernard R. Brooks, Dimitri Van Neck, Michel Waroquier

J. Comput. Chem., 2010