GOA COFs

GOA COFs

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BOFGOA2017000301

Promotor(s)

P. Van der Voort, V. Van Speybroeck

Attachments (ZAP restricted field)

2016-toekenning-GOA.pdf

Project funding (ZAP restricted)

Promotore(n): P. Van der Voort, V. Van Speybroeck

Financierende instantie: BOF-GOA

Data: 01/01/2017 to 31/12/2021

Bedrag: €1.650.000,00

Title: Model based synthesis of covalent organic frameworks

Project publications (A1)

J. De Vos, S. Ravichandran, S. Borgmans, L. Vanduyfhuys, P. Van der Voort, S.M.J. Rogge, V. Van Speybroeck

High-Throughput Screening of Covalent Organic Frameworks for Carbon Capture Using Machine Learning

Chemistry of Materials 36, 9, 4315-4330 (2024)

http://dx.doi.org/10.1021/acs.chemmater.3c03230

S. Borgmans, S.M.J. Rogge, L. Vanduyfhuys, V. Van Speybroeck

OGRe: Optimal grid refinement protocol for accurate free energy surfaces and its application to proton hopping in zeolites and 2D COF stacking

Journal of Chemical Theory and Computation 19, 24, 9032-9048 (2024)

https://doi.org/10.1021/acs.jctc.3c01028

A. Chatterjee, J. Sun, K. S. Rawat, V. Van Speybroeck, P. Van der Voort

Exploring the Charge Storage Dynamics in Donor–Acceptor Covalent Organic Frameworks Based Supercapacitors by Employing Ionic Liquid Electrolyte

SMALL Volume: 19, Issue: 46 (2023)

http://dx.doi.org/10.1002/smll.202303189

S.M.J. Rogge, S. Borgmans, V. Van Speybroeck

Absorbing stress via molecular crumple zones: Strain engineering flexibility into the rigid UiO-66 material

Matter 6, 5, 1435-1462 (2023)

http://dx.doi.org/10.1016/j.matt.2023.02.009

J. De Vos, S. Borgmans, P. Van der Voort, S.M.J. Rogge, V. Van Speybroeck

ReDD-COFFEE: A ready-to-use database of covalent organic framework structures and accurate force fields to enable high-throughput screenings

J. Mater. Chem. A 11, 14, 7468-7487 (2023)

http://dx.doi.org/10.1039/D3TA00470H

K. S. Rawat, S. Borgmans, T. Braeckevelt, C.V. Stevens, P. Van der Voort, V. Van Speybroeck

How the Layer Alignment in Two-dimensional Nanoporous Covalent Organic Frameworks Impacts Its Electronic Properties

ACS Applied Nano Materials 5, 10, 14377-14387 (2022)

https://doi.org/10.1021/acsanm.2c02647

H. Salemi, M. Debruyne, V. Van Speybroeck, P. Van der Voort, M. D'Hooghe, C. Stevens

Covalent Organic Framework supported Palladium Catalysts

Journal of Materials Chemistry A 10, 39, 20707-20729 (2022)

https://doi.org/10.1039/D2TA05234B

J. Everaert, M. Debruyne, F. Vandenbussche, K. Van Hecke, T.S.A Heugebaert, P. Van der Voort, V. Van Speybroeck, C. Stevens

Synthesis of Nitrile-Functionalized Polydentate N-Heterocycles as Building Blocks for Covalent Triazine Frameworks

Synthesis-Stuttgart (2021)

http://dx.doi.org/10.1055/a-1626-5749

M. Debruyne, V. Van Speybroeck, P. Van der Voort, C. Stevens

Porous organic polymers as metal free heterogeneous organocatalysts

Green Chemistry Volume 23, Issue 19, Page 7361-7434 (2021)

10.1039/d1gc02319e

S. Borgmans, S.M.J. Rogge, J. De Vos, C.V. Stevens, P. Van der Voort, V. Van Speybroeck

Quantifying the likelihood of structural models through a dynamically enhanced powder X‐ray diffraction protocol

Angewandte Chemie int. Ed. 60 (16), 8913-8922 (2021)

http://dx.doi.org/10.1002/anie.202017153

F. Vanden Bussche, A.M. Kaczmarek, S. K. P. Veerapandian, J. Everaert, M. Debruyne, S. Abednatanzi, R. Morent, N. De Geyter, V. Van Speybroeck, P. Van der Voort, C.V. Stevens

N‐rich porous polymer with isolated Tb3+‐ions displays unique temperature dependent behavior through the absence of thermal quenching

Chemistry - A European Journal 26 (67), 15596-15604 (2020)

http://dx.doi.org/10.1002/chem.202002009

C. Krishnaraj, H. S. Jena, L. Bourda, A. Laemont, P. Pachfule, J. Roeser, C. V. Chandran, S. Borgmans, S.M.J. Rogge, K. Leus, C.V. Stevens, J.A. Martens, V. Van Speybroeck, E. Breynaert, A. Thomas, P. Van der Voort

Strongly Reducing (Diarylamino)benzene Based Covalent Organic Framework for Metal-Free Visible Light Photocatalytic H2O2 Generation

JACS (Journal of the American Chemical Society) 142 (47), 20107-20116 (2020)

http://dx.doi.org/10.1021/jacs.0c09684

L. De Bruecker, J. Everaert, P. Van der Voort, C.V. Stevens, M. Waroquier, V. Van Speybroeck

Structural and photophysical properties of various polypyridyl ligands: A combined experimental and computational study

ChemPhysChem 21 (22), 2489–2505 (2020)

https://doi.org/10.1002/cphc.202000592

S. Abednatanzi, P. Gohari Derakhshandeh, P. Tack, F. Muniz-Miranda, Y-Y Liu, J. Everaert, M. Meledina, F. Vanden Bussche, L. Vincze, C. Stevens, V. Van Speybroeck, H. Vrielinck, F. Callens, K. Leus, P. Van der Voort

Elucidating the promotional effect of a covalent triazine framework in aerobic oxidation

Applied Catalysis B: Environmental 269, 118769 (2020)

http://dx.doi.org/10.1016/j.apcatb.2020.118769

F. Muniz-Miranda, L. De Bruecker, A. De Vos, F. Vanden Bussche, C.V. Stevens, P. Van der Voort, K. Lejaeghere, V. Van Speybroeck

Optical Properties of Isolated and Covalent Organic Framework-Embedded Ruthenium Complexes

Journal of Physical Chemistry A 123 (32), 6854-6867 (2019)

http://dx.doi.org/10.1021/acs.jpca.9b05216

N. Tahir, F. Muniz-Miranda, J. Everaert, P. Tack, T.S.A Heugebaert, K. Leus, L. Vincze, C. Stevens, V. Van Speybroeck, P. Van der Voort

Immobilization of Ir(I) complex on Covalent Triazine Frameworks for C-H Borylation Reactions: A Combined Experimental and Computational Study

Journal of Catalysis 371, 135-143 (2019)

http://dx.doi.org/10.1016/j.jcat.2019.01.030

A. De Vos, K. Lejaeghere, F. Muniz-Miranda, C. Stevens, P. Van der Voort, V. Van Speybroeck

Electronic properties of heterogenized Ru(II) polypyridyl photoredox complexes on covalent triazine frameworks

Journal of Materials Chemistry A 7, 8433-8442 (2019)

http://dx.doi.org/10.1039/C9TA00573K

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GOA COFs

Primary tabs

Content

New SAP ref.

Promotor(s)

Attachments (ZAP restricted field)

Project funding (ZAP restricted)

Project publications (A1)

Postscript First

Postscript Second

Postscript Third

Preface First

Preface Second

Preface Third