Academic Bibliography

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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

Diego R Alcoba, Alicia Torre, Luis Lain, Gustavo E Massaccesi, Ofelia B Ona, Eduardo M Honore, Ward Poelmans (UGent) , Dimitri Van Neck (UGent) , Patrick Bultinck (UGent) and Stijn De Baerdemacker (UGent)

(2018) JOURNAL OF CHEMICAL PHYSICS. 148(2).

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Method for making 2-electron response reduced density matrices approximately N-representable

Caitlin Lanssens (UGent) , Paul W Ayers, Dimitri Van Neck (UGent) , Stijn De Baerdemacker (UGent) , Klaas Gunst (UGent) and Patrick Bultinck (UGent)

(2018) JOURNAL OF CHEMICAL PHYSICS. 148(8).

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Variational method for integrability-breaking Richardson-Gaudin models

Pieter Claeys (UGent) , Jean-Sébastien Caux, Dimitri Van Neck (UGent) and Stijn De Baerdemacker (UGent)

(2017) PHYSICAL REVIEW B. 96(15).

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Strategies for extending geminal-based wavefunctions : open shells and beyond

Paul A Johnson, Peter A Limacher, Taewon D Kim, Michael Richer, Ramon Alain Miranda-Quintana, Farnaz Heidar Zadeh (UGent) , Paul W Ayers, Patrick Bultinck (UGent) , Stijn De Baerdemacker (UGent) and Dimitri Van Neck (UGent)

(2017) COMPUTATIONAL AND THEORETICAL CHEMISTRY. 1116. p.207-219

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journalArticle
A1
open access

Block product density matrix embedding theory for strongly correlated spin systems

Klaas Gunst (UGent) , Sebastian Wouters (UGent) , Stijn De Baerdemacker (UGent) and Dimitri Van Neck (UGent)

(2017) PHYSICAL REVIEW B. 95(19).

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Read-Green resonances in a topological superconductor coupled to a bath

Pieter Claeys (UGent) , Stijn De Baerdemacker (UGent) and Dimitri Van Neck (UGent)

(2016) PHYSICAL REVIEW B. 93(22).

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journalArticle
A1
open access

Maximum probability domains for Hubbard models

Guillaume Acke (UGent) , Stijn De Baerdemacker (UGent) , Pieter Claeys (UGent) , Mario Van Raemdonck (UGent) , Ward Poelmans (UGent) , Dimitri Van Neck (UGent) and Patrick Bultinck (UGent)

(2016) MOLECULAR PHYSICS. 114(7-8). p.1392-1405

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Performance of Shannon-entropy compacted N-electron wave functions for configuration interaction methods

Diego R Alcoba, Alicia Torre, Luis Lain, Gustavo E Massaccesi, Ofelia B Oña, Paul W Ayers, Mario Van Raemdonck (UGent) , Patrick Bultinck (UGent) and Dimitri Van Neck (UGent)

(2016) THEORETICAL CHEMISTRY ACCOUNTS. 135(6).

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Constrained CI calculations to investigate charge transfer and the effects of the integer nature of the electron

Mario Van Raemdonck (UGent) , Stijn De Baerdemacker (UGent) , Guillaume Acke (UGent) , Frank De Proft, Dimitri Van Neck (UGent) and Patrick Bultinck (UGent)

(2016) Abstract book : Solvay workshop on 'Conceptual quantum chemistry: present aspects and challenges for the future'. p.55-55

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Atom and bond Fukui functions and matrices : a Hirshfeld-I atoms-in-molecule approach

Ofelia B Oña, Olivier De Clercq (UGent) , Diego R Alcoba, Alicia Torre, Luis Lain, Dimitri Van Neck (UGent) and Patrick Bultinck (UGent)

(2016) CHEMPHYSCHEM. 17(18). p.2881-2889

Academic Bibliography

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

Method for making 2-electron response reduced density matrices approximately N-representable

Variational method for integrability-breaking Richardson-Gaudin models

Strategies for extending geminal-based wavefunctions : open shells and beyond

Block product density matrix embedding theory for strongly correlated spin systems

Read-Green resonances in a topological superconductor coupled to a bath

Maximum probability domains for Hubbard models

Performance of Shannon-entropy compacted N-electron wave functions for configuration interaction methods

Constrained CI calculations to investigate charge transfer and the effects of the integer nature of the electron

Atom and bond Fukui functions and matrices : a Hirshfeld-I atoms-in-molecule approach

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