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List of works by Ward Poelmans

CheMPS2 : Improved DMRG-SCF routine and correlation functions

scientific article published in June 2015

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

scholarly article by Sebastian Wouters et al published June 2014 in Computer Physics Communications

Critical analysis of the accuracy of models predicting or extracting liquid structure information

scientific article published on 20 February 2014

Direct variational determination of the two-electron reduced density matrix for doubly occupied-configuration-interaction wave functions: The influence of three-index N-representability conditions

scientific article published in January 2018

Extensive v2DM study of the one-dimensional Hubbard model for large lattice sizes: Exploiting translational invariance and parity

scientific article published in January 2013

Maximum probability domains for Hubbard models ⬇️

scientific article published on 29 February 2016

Polynomial scaling approximations and dynamic correlation corrections to doubly occupied configuration interaction wave functions

scientific article published in September 2015

Reproducibility in density functional theory calculations of solids

scientific article

Variational Optimization of the Second-Order Density Matrix Corresponding to a Seniority-Zero Configuration Interaction Wave Function.

scientific article

Variational optimization of the 2DM: approaching three-index accuracy using extended cluster constraints

scientific article published in March 2014

Variational two-particle density matrix calculation for the Hubbard model below half filling using spin-adapted lifting conditions

scientific article published on 21 May 2012

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