Effect of metal–organic framework (MOF) database selection on the assessment of gas storage and separation potentials of MOFs H Daglar, HC Gulbalkan, G Avci, GO Aksu, OF Altundal, C Altintas, ... Angewandte Chemie International Edition 60 (14), 7828-7837, 2021 | 235 | 2021 |
Assessing CH4/N2 separation potential of MOFs, COFs, IL/MOF, MOF/Polymer, and COF/Polymer composites HC Gulbalkan, ZP Haslak, C Altintas, A Uzun, S Keskin Chemical Engineering Journal 428, 131239, 2022 | 107 | 2022 |
MOF membranes for CO2 capture: past, present and future H Demir, GO Aksu, HC Gulbalkan, S Keskin Carbon Capture Science & Technology 2, 100026, 2022 | 69 | 2022 |
Recent advances in computational modeling of MOFs: From molecular simulations to machine learning H Demir, H Daglar, HC Gulbalkan, GO Aksu, S Keskin Coordination Chemistry Reviews 484, 215112, 2023 | 59 | 2023 |
Composites of porous materials with ionic liquids: Synthesis, characterization, applications, and beyond Ö Durak, M Zeeshan, N Habib, HC Gulbalkan, AAAM Alsuhile, ... Microporous and Mesoporous Materials, 111703, 2022 | 45 | 2022 |
Doubling CO2/N2 separation performance of CuBTC by incorporation of 1-n-ethyl-3-methylimidazolium diethyl phosphate M Zeeshan, HC Gulbalkan, ZP Haslak, S Keskin, A Uzun Microporous and Mesoporous Materials 316, 110947, 2021 | 24 | 2021 |
An Integrated Computational–Experimental Hierarchical Approach for the Rational Design of an IL/UiO‐66 Composite Offering Infinite CO2 Selectivity M Zeeshan, HC Gulbalkan, O Durak, ZP Haslak, U Unal, S Keskin, ... Advanced Functional Materials 32 (35), 2204149, 2022 | 23 | 2022 |
Multi-scale computational screening to accelerate discovery of IL/COF composites for CO2/N2 separation HC Gulbalkan, ZP Haslak, C Altintas, A Uzun, S Keskin Separation and Purification Technology 287, 120578, 2022 | 18 | 2022 |
Integrating Molecular Simulations with Machine Learning Guides in the Design and Synthesis of [BMIM][BF4]/MOF Composites for CO2/N2 Separation H Daglar, HC Gulbalkan, N Habib, O Durak, A Uzun, S Keskin ACS Applied Materials & Interfaces 15 (13), 17421-17431, 2023 | 14 | 2023 |
Accelerated Discovery of Metal–Organic Frameworks for CO2 Capture by Artificial Intelligence HC Gulbalkan, GO Aksu, G Ercakir, S Keskin Industrial & Engineering Chemistry Research 63 (1), 37-48, 2023 | 5 | 2023 |
Composite of MIL-101(Cr) with a Pyrrolidinium-Based Ionic Liquid Providing High CO2 Selectivity N Habib, O Durak, HC Gulbalkan, AS Aydogdu, S Keskin, A Uzun ACS Applied Engineering Materials 1 (6), 1473-1481, 2023 | 5 | 2023 |
Evaluating CH4/N2 Separation Performances of Hundreds of Thousands of Real and Hypothetical MOFs by Harnessing Molecular Modeling and Machine Learning HC Gulbalkan, A Uzun, S Keskin ACS Applied Materials & Interfaces, 2023 | 4 | 2023 |
Combining computational screening and machine learning to explore MOFs and COFs for methane purification HC Gulbalkan, A Uzun, S Keskin Applied Physics Letters 124 (20), 2024 | 1 | 2024 |
Boosting CO2 separation in porphyrinic MOF-based mixed matrix membranes via central metal atom integration N Prasetya, HC Gülbalkan, S Keskin, C Wöll Carbon Capture Science & Technology 13, 100252, 2024 | | 2024 |
Molecular engineering of a MOF with an ionic liquid sheath for direct air separation at ambient conditions O Durak, N Habib, HC Gulbalkan, AS Aydogdu, R Ozdemir, S Keskin, ... Chemical Engineering Journal, 152608, 2024 | | 2024 |
Computational Simulations of Metal–Organic Frameworks to Enhance Adsorption Applications H Daglar, HC Gulbalkan, GO Aksu, S Keskin Advanced Materials, 2405532, 2024 | | 2024 |