Derk Kooi

20152019
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Density functional theory Chemical Compounds
Electron-electron interactions Chemical Compounds
Discrete Fourier transforms Chemical Compounds
density functional theory Physics & Astronomy
interpolation Physics & Astronomy
Interpolation Chemical Compounds
flux density Physics & Astronomy
Pipelines Chemical Compounds

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Research Output 2015 2019

A Variational Approach to London Dispersion Interactions without Density Distortion

Kooi, D. P. & Gori-Giorgi, P., 4 Apr 2019, In : Journal of Physical Chemistry Letters. 10, 7, p. 1537-1541 5 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
Monomers
Atoms
monomers
interactions
Wave functions

Local and global interpolations along the adiabatic connection of DFT: a study at different correlation regimes

Kooi, D. P. & Gori-Giorgi, P., Dec 2018, In : Theoretical Chemistry Accounts. 137, 12, p. 1-12 12 p., 166.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
Discrete Fourier transforms
interpolation
Interpolation
flux density
Kinetic energy

eTOX ALLIES: an automated pipeLine for linear interaction energy-based simulations

Capoferri, C. L., van Dijk, M., Rustenburg, A. S., Wassenaar, T., Kooi, D. P., Rifai, E. A., Vermeulen, N. P. E. & Geerke, D. P., 2017, In : Journal of Cheminformatics. 9, 58, p. 1-13 13 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
Pipelines
Ligands
Free energy
energy
ligands

Fermionic Statistics in the Strongly Correlated Limit of Density Functional Theory

Grossi, J., Kooi, D. P., Giesbertz, K. J. H., Seidl, M., Cohen, A. J., Mori-Sánchez, P. & Gori-Giorgi, P., 12 Dec 2017, In : Journal of Chemical Theory and Computation. 13, 12, p. 6089-6100 12 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
Electron-electron interactions
Density functional theory
Statistics
statistics
density functional theory

The effect of N-acetylcysteine on brain glutamate and gamma-aminobutyric acid concentrations and on smoking cessation: A randomized, double-blind, placebo-controlled trial

Schulte, M. H. J., Goudriaan, A. E., Kaag, A. M., Kooi, D. P., Van Den Brink, W., Wiers, R. W. & Schmaal, L., 1 Oct 2017, In : Journal of Psychopharmacology. 31, 10, p. 1377-1379 3 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
Gyrus Cinguli
Acetylcysteine
Smoking Cessation
gamma-Aminobutyric Acid
Glutamic Acid