De Baerdemacker S - Search Results

1

Spin Polarization through Floquet Resonances in a Driven Central Spin Model.

Claeys PW, De Baerdemacker S, Araby OE, Caux JS. Claeys PW, et al. Among authors: de baerdemacker s. Phys Rev Lett. 2018 Aug 24;121(8):080401. doi: 10.1103/PhysRevLett.121.080401. Phys Rev Lett. 2018. PMID: 30192602

2

Quasi-1D physics in metal-organic frameworks: MIL-47(V) from first principles.

Vanpoucke DE, Jaeken JW, De Baerdemacker S, Lejaeghere K, Van Speybroeck V. Vanpoucke DE, et al. Among authors: de baerdemacker s. Beilstein J Nanotechnol. 2014 Oct 9;5:1738-48. doi: 10.3762/bjnano.5.184. eCollection 2014. Beilstein J Nanotechnol. 2014. PMID: 25383285 Free PMC article.

3

Uncovering phase transitions that underpin the flat-planes in the tilted Hubbard model using subsystems and entanglement measures.

De Vriendt X, Van Hende D, De Baerdemacker S, Bultinck P, Acke G. De Vriendt X, et al. Among authors: de baerdemacker s. J Chem Phys. 2022 Jun 28;156(24):244115. doi: 10.1063/5.0092153. J Chem Phys. 2022. PMID: 35778100

4

Quantifying Delocalization and Static Correlation Errors by Imposing (Spin)Population Redistributions through Constraints on Atomic Domains.

De Vriendt X, Lemmens L, De Baerdemacker S, Bultinck P, Acke G. De Vriendt X, et al. Among authors: de baerdemacker s. J Chem Theory Comput. 2021 Nov 9;17(11):6808-6818. doi: 10.1021/acs.jctc.1c00326. Epub 2021 Oct 1. J Chem Theory Comput. 2021. PMID: 34597030

5

Projected seniority-two orbital optimization of the antisymmetric product of one-reference orbital geminal.

Boguslawski K, Tecmer P, Limacher PA, Johnson PA, Ayers PW, Bultinck P, De Baerdemacker S, Van Neck D. Boguslawski K, et al. Among authors: de baerdemacker s. J Chem Phys. 2014 Jun 7;140(21):214114. doi: 10.1063/1.4880820. J Chem Phys. 2014. PMID: 24907997

6

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

Van Raemdonck M, Alcoba DR, Poelmans W, De Baerdemacker S, Torre A, Lain L, Massaccesi GE, Van Neck D, Bultinck P. Van Raemdonck M, et al. Among authors: de baerdemacker s. J Chem Phys. 2015 Sep 14;143(10):104106. doi: 10.1063/1.4930260. J Chem Phys. 2015. PMID: 26374017 Free article.

7

Richardson-Gaudin mean-field for strong correlation in quantum chemistry.

Johnson PA, Fecteau CÉ, Berthiaume F, Cloutier S, Carrier L, Gratton M, Bultinck P, De Baerdemacker S, Van Neck D, Limacher P, Ayers PW. Johnson PA, et al. Among authors: de baerdemacker s. J Chem Phys. 2020 Sep 14;153(10):104110. doi: 10.1063/5.0022189. J Chem Phys. 2020. PMID: 32933287

8

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.

Alcoba DR, Torre A, Lain L, Massaccesi GE, Oña OB, Honoré EM, Poelmans W, Van Neck D, Bultinck P, De Baerdemacker S. Alcoba DR, et al. Among authors: de baerdemacker s. J Chem Phys. 2018 Jan 14;148(2):024105. doi: 10.1063/1.5008811. J Chem Phys. 2018. PMID: 29331147

9

A New Mean-Field Method Suitable for Strongly Correlated Electrons: Computationally Facile Antisymmetric Products of Nonorthogonal Geminals.

Limacher PA, Ayers PW, Johnson PA, De Baerdemacker S, Van Neck D, Bultinck P. Limacher PA, et al. Among authors: de baerdemacker s. J Chem Theory Comput. 2013 Mar 12;9(3):1394-401. doi: 10.1021/ct300902c. Epub 2013 Feb 13. J Chem Theory Comput. 2013. PMID: 26587601

10

Nonvariational Orbital Optimization Techniques for the AP1roG Wave Function.

Boguslawski K, Tecmer P, Bultinck P, De Baerdemacker S, Van Neck D, Ayers PW. Boguslawski K, et al. Among authors: de baerdemacker s. J Chem Theory Comput. 2014 Nov 11;10(11):4873-82. doi: 10.1021/ct500759q. Epub 2014 Oct 13. J Chem Theory Comput. 2014. PMID: 26584374

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My NCBI Filters

Text availability

Article attribute

Article type

Publication date

15 results

Search Page