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 | 231 | 2021 |
[BMIM][PF6] Incorporation Doubles CO2 Selectivity of ZIF-8: Elucidation of Interactions and Their Consequences on Performance FP Kinik, C Altintas, V Balci, B Koyuturk, A Uzun, S Keskin ACS Applied Materials & Interfaces 8 (45), 30992-31005, 2016 | 156 | 2016 |
Database for CO2 Separation Performances of MOFs Based on Computational Materials Screening C Altintas, G Avci, H Daglar, A Nemati Vesali Azar, S Velioglu, I Erucar, ... ACS applied materials & interfaces 10 (20), 17257-17268, 2018 | 152 | 2018 |
Machine learning meets with metal organic frameworks for gas storage and separation C Altintas, OF Altundal, S Keskin, R Yildirim Journal of Chemical Information and Modeling 61 (5), 2131-2146, 2021 | 142 | 2021 |
High-Throughput Computational Screening of the Metal Organic Framework Database for CH4/H2 Separations C Altintas, I Erucar, S Keskin ACS applied materials & interfaces 10 (4), 3668-3679, 2018 | 125 | 2018 |
Improving Gas Separation Performance of ZIF-8 by [BMIM][BF4] Incorporation: Interactions and Their Consequences on Performance B Koyuturk, C Altintas, FP Kinik, S Keskin, A Uzun The Journal of Physical Chemistry C 121 (19), 10370-10381, 2017 | 125 | 2017 |
An extensive comparative analysis of two MOF databases: high-throughput screening of computation-ready MOFs for CH 4 and H 2 adsorption C Altintas, G Avci, H Daglar, ANV Azar, I Erucar, S Velioglu, S Keskin Journal of Materials Chemistry A 7 (16), 9593-9608, 2019 | 106 | 2019 |
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 | 105 | 2022 |
Molecular Simulations of MOF Membranes and Performance Predictions of MOF/Polymer Mixed Matrix Membranes for CO2/CH4 Separations C Altintas, S Keskin ACS sustainable chemistry & engineering 7 (2), 2739-2750, 2018 | 94 | 2018 |
Can COFs replace MOFs in flue gas separation? high-throughput computational screening of COFs for CO 2/N 2 separation OF Altundal, C Altintas, S Keskin Journal of Materials Chemistry A 8 (29), 14609-14623, 2020 | 86 | 2020 |
Computational screening of MOFs for C2H6/C2H4 and C2H6/CH4 separations C Altintas, S Keskin Chemical Engineering Science 139, 49-60, 2016 | 77 | 2016 |
Computer simulations of 4240 MOF membranes for H 2/CH 4 separations: insights into structure–performance relations C Altintas, G Avci, H Daglar, E Gulcay-Ozcan, I Erucar, S Keskin Journal of Materials Chemistry A 6 (14), 5836-5847, 2018 | 68 | 2018 |
Metal-organic framework-based materials for the abatement of air pollution and decontamination of wastewater H Daglar, C Altintas, I Erucar, G Heidari, EN Zare, O Moradi, V Srivastava, ... Chemosphere 303, 135082, 2022 | 48 | 2022 |
Computational Selection of High-Performing Covalent Organic Frameworks for Adsorption and Membrane-Based CO2/H2 Separation GO Aksu, H Daglar, C Altintas, S Keskin The Journal of Physical Chemistry C 124 (41), 22577-22590, 2020 | 45 | 2020 |
High-Throughput Screening of COF Membranes and COF/Polymer MMMs for Helium Separation and Hydrogen Purification S Aydin, C Altintas, S Keskin ACS Applied Materials & Interfaces 14 (18), 21738-21749, 2022 | 44 | 2022 |
Role of partial charge assignment methods in high-throughput screening of MOF adsorbents and membranes for CO 2/CH 4 separation C Altintas, S Keskin Molecular Systems Design & Engineering 5 (2), 532-543, 2020 | 40 | 2020 |
Oxalamide-Functionalized Metal Organic Frameworks for CO2 Adsorption Y Guclu, H Erer, H Demiral, C Altintas, S Keskin, N Tumanov, BL Su, ... Acs Applied Materials & Interfaces 13 (28), 33188-33198, 2021 | 37 | 2021 |
Molecular simulations of MOF membranes for separation of ethane/ethene and ethane/methane mixtures C Altintas, S Keskin RSC advances 7 (82), 52283-52295, 2017 | 31 | 2017 |
MOF/COF hybrids as next generation materials for energy and biomedical applications C Altintas, I Erucar, S Keskin CrystEngComm 24 (42), 7360-7371, 2022 | 24 | 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 |