| How reproducible are surface areas calculated from the BET equation? JWM Osterrieth, J Rampersad, D Madden, N Rampal, L Skoric, ... Advanced Materials 34 (27), 2201502, 2022 | 154 | 2022 |
| Thermal Engineering of Metal–Organic Frameworks for Adsorption Applications: A Molecular Simulation Perspective J Wieme, S Vandenbrande, A Lamaire, V Kapil, L Vanduyfhuys, ... ACS applied materials & interfaces 11 (42), 38697-38707, 2019 | 75 | 2019 |
| High-rate nanofluidic energy absorption in porous zeolitic frameworks Y Sun, SMJ Rogge, A Lamaire, S Vandenbrande, J Wieme, CR Siviour, ... Nature Materials 20 (7), 1015-1023, 2021 | 58 | 2021 |
| Truly combining the advantages of polymeric and zeolite membranes for gas separations X Tan, S Robijns, R Thür, Q Ke, N De Witte, A Lamaire, Y Li, I Aslam, ... Science 378 (6625), 1189-1194, 2022 | 50 | 2022 |
| Modeling the Structural and Thermal Properties of Loaded Metal–Organic Frameworks. An Interplay of Quantum and Anharmonic Fluctuations V Kapil, J Wieme, S Vandenbrande, A Lamaire, V Van Speybroeck, ... Journal of chemical theory and computation 15 (5), 3237-3249, 2019 | 33 | 2019 |
| Correlating MOF-808 parameters with mixed-matrix membrane (MMM) CO 2 permeation for a more rational MMM development R Thür, D Van Havere, N Van Velthoven, S Smolders, A Lamaire, ... Journal of Materials Chemistry A 9 (21), 12782-12796, 2021 | 30 | 2021 |
| Nuclear quantum effects on zeolite proton hopping kinetics explored with machine learning potentials and path integral molecular dynamics M Bocus, R Goeminne, A Lamaire, M Cools-Ceuppens, T Verstraelen, ... Nature Communications 14 (1), 1008, 2023 | 24 | 2023 |
| Atomistic insight in the flexibility and heat transport properties of the stimuli-responsive metal–organic framework MIL-53 (Al) for water-adsorption applications using … A Lamaire, J Wieme, AEJ Hoffman, V Van Speybroeck Faraday Discussions 225, 301-323, 2021 | 21 | 2021 |
| On the importance of anharmonicities and nuclear quantum effects in modelling the structural properties and thermal expansion of MOF-5 A Lamaire, J Wieme, SMJ Rogge, M Waroquier, V Van Speybroeck The Journal of Chemical Physics 150 (9), 2019 | 18 | 2019 |
| Quantum Free Energy Profiles for Molecular Proton Transfers A Lamaire, M Cools-Ceuppens, M Bocus, T Verstraelen, ... Journal of Chemical Theory and Computation 19 (1), 18-24, 2022 | 2 | 2022 |
| How Reproducible are Surface Areas Calculated from the BET Equation?(Adv. Mater. 27/2022) JWM Osterrieth, J Rampersad, D Madden, N Rampal, L Skoric, ... Advanced Materials 34 (27), 2270205, 2022 | 2 | 2022 |
| Water motifs in zirconium metal-organic frameworks induced by nanoconfinement and hydrophilic adsorption sites V Van Speybroeck, A Lamaire, S Rogge, J Wieme | | 2024 |
| Unraveling the Mechanisms of Zirconium Metal–Organic Frameworks‐Based Mixed‐Matrix Membranes Preventing Polysulfide Shuttling W Lu, Z Pang, A Lamaire, F Liu, S Dai, ML Pinto, R Demir‐Cakan, ... Small Science, 2300339, 2024 | | 2024 |
| Unraveling the mechanisms of Zirconium MOFs based Mixed Matrix Membranes Preventing Polysulfide Shuttling W Lu, Z Pang, A Lamaire, F Liu, S Dai, ML Pinto, R Demir-Cakan, KO Tan, ... | | 2023 |
| Quantum tunneling rotor as a sensitive atomistic probe of guests in a metal-organic framework K Titov, MR Ryder, A Lamaire, Z Zeng, AK Chaudhari, J Taylor, EM Mahdi, ... Physical Review Materials 7 (7), 073402, 2023 | | 2023 |
| Nuclear quantum effects on zeolite proton hopping kinetics explored with machine learning potentials and path integral molecular dynamics M Bocus, R Goeminne, A Lamaire, M Cools-Ceuppens, T Verstraelen, ... Nature Communications 14 (1), 1008, 2023 | | 2023 |
| On the impact of nuclear quantum effects on zeolite proton hopping kinetics through machine learning potentials and path integral molecular dynamics simulations M Bocus, R Goeminne, A Lamaire, M Cools-Ceuppens, T Verstraelen, ... | | 2022 |
| Introducing nuclear quantum effects via colored-noise thermostats and path integral methods to simulate metal-organic frameworks A Lamaire Ghent University, 2017 | | 2017 |
| Truly combining the advantages of polymeric and zeolite membranes for ultra-high performance gas separations X Tan, S Robijns, R Thür, Q Ke, N De Witte, A Lamaire, Y Li, I Aslam, ... | | |
