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Guillaume Acke
Guillaume Acke
Postdoctoral researcher, Ghent University
Verified email at UGent.be - Homepage
Title
Cited by
Cited by
Year
Can the current density map topology be extracted from the nucleus independent chemical shifts?
S Van Damme, G Acke, RWA Havenith, P Bultinck
Physical Chemistry Chemical Physics 18 (17), 11746-11755, 2016
712016
Polyaddition synthesis using alkyne esters for the design of vinylogous urethane vitrimers
Y Spiesschaert, J Danneels, N Van Herck, M Guerre, G Acke, J Winne, ...
Macromolecules 54 (17), 7931-7942, 2021
352021
Interpreting the behavior of the by resolving in orbitals, sign, and positions
G Acke, S Van Damme, RWA Havenith, P Bultinck
Journal of Computational Chemistry 39 (9), 511-519, 2018
332018
Influence of electron correlation and degeneracy on the Fukui matrix and extension of frontier molecular orbital theory to correlated quantum chemical methods
P Bultinck, D Van Neck, G Acke, PW Ayers
Physical Chemistry Chemical Physics 14 (7), 2408-2416, 2012
292012
Quantifying the conceptual problems associated with the isotropic NICS through analyses of its underlying density
G Acke, S Van Damme, RWA Havenith, P Bultinck
Physical Chemistry Chemical Physics 21 (6), 3145-3153, 2019
252019
Extended random phase approximation method for atomic excitation energies from correlated and variationally optimized second-order density matrices
H van Aggelen, B Verstichel, G Acke, M Degroote, P Bultinck, PW Ayers, ...
Computational and Theoretical Chemistry 1003, 50-54, 2013
202013
GQCP: The Ghent quantum chemistry package
L Lemmens, X De Vriendt, D Van Hende, T Huysentruyt, P Bultinck, ...
The Journal of Chemical Physics 155 (8), 2021
172021
Maximum probability domains for Hubbard models
G Acke, S De Baerdemacker, PW Claeys, M Van Raemdonck, ...
Molecular Physics 114 (7-8), 1392-1405, 2016
152016
Exploring machine learning methods for absolute configuration determination with vibrational circular dichroism
T Vermeyen, J Brence, R Van Echelpoel, R Aerts, G Acke, P Bultinck, ...
Physical Chemistry Chemical Physics 23 (35), 19781-19789, 2021
102021
Crosstalk between glucocorticoid and mineralocorticoid receptors boosts glucocorticoid-induced killing of multiple myeloma cells
D Clarisse, S Prekovic, P Vlummens, E Staessens, K Van Wesemael, ...
Cellular and Molecular Life Sciences 80 (9), 249, 2023
92023
Quantifying Delocalization and Static Correlation Errors by Imposing (Spin) Population Redistributions through Constraints on Atomic Domains
X De Vriendt, L Lemmens, S De Baerdemacker, P Bultinck, G Acke
Journal of Chemical Theory and Computation 17 (11), 6808-6818, 2021
92021
Hierarchies of quantum chemical descriptors induced by statistical analyses of domain occupation number operators
G Acke, S De Baerdemacker, A Martin Pendas, P Bultinck
Wiley Interdisciplinary Reviews: Computational Molecular Science 10 (4), e1456, 2020
92020
Uncovering phase transitions that underpin the flat-planes in the tilted Hubbard model using subsystems and entanglement measures
X De Vriendt, D Van Hende, S De Baerdemacker, P Bultinck, G Acke
The Journal of Chemical Physics 156 (24), 2022
62022
Uncovering Clar's aromatic‐sextet rule in the Hubbard model using Maximum Probability Domain Partitions
D Van Hende, L Lemmens, S De Baerdemacker, D Van Neck, P Bultinck, ...
Journal of Computational Chemistry 43 (7), 457-464, 2022
62022
Analyzing the behavior of spin phases in external magnetic fields by means of spin-constrained states
L Lemmens, X De Vriendt, P Bultinck, G Acke
Journal of Chemical Theory and Computation 18 (6), 3364-3376, 2022
42022
The influence of correlation on (de)localization indices from a valence bond perspective
G Acke, P Bultinck
Journal of Molecular Modeling 24 (10), 275, 2018
42018
Extending Conceptual Density Functional Theory toward First-Order Reduced Density Matrices: An Open Subsystems Viewpoint on the Fukui Matrix
G Acke, D Van Hende, X De Vriendt, P Bultinck
Journal of Chemical Theory and Computation 19 (16), 5418-5426, 2023
22023
Capturing correlation in the spin frustrated H3-ring using the generator coordinate method and spin-constrained generalised Hartree-Fock states
X De Vriendt, J De Vos, S De Baerdemacker, P Bultinck, G Acke
Molecular Physics 121 (9-10), e2134831, 2023
22023
Quantum Information Patterns Between Atoms in a Molecule
D Van Hende, R Van der Stichelen, P Bultinck, G Acke
Chemistry–A European Journal 30 (60), e202400819, 2024
12024
Performance of DFT methods in momentum space: quantum similarity measures versus moments of momentum
J Vandenbussche, G Acke, P Bultinck
Journal of Chemical Theory and Computation 9 (9), 3908-3916, 2013
12013
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