Seda Keskin, Ph.D. - Publications

Affiliations: 
2009 Georgia Institute of Technology, Atlanta, GA 
Area:
Transport Through Nanoporous Materials, Chiral Surface Chemistry

126 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Gulbalkan HC, Aksu GO, Ercakir G, Keskin S. Accelerated Discovery of Metal-Organic Frameworks for CO Capture by Artificial Intelligence. Industrial & Engineering Chemistry Research. 63: 37-48. PMID 38223500 DOI: 10.1021/acs.iecr.3c03817  0.368
2023 Ercakir G, Aksu GO, Altintas C, Keskin S. Hierarchical Computational Screening of Quantum Metal-Organic Framework Database to Identify Metal-Organic Frameworks for Volatile Organic-Compound Capture from Air. Acs Engineering Au. 3: 488-497. PMID 38144678 DOI: 10.1021/acsengineeringau.3c00039  0.386
2023 Gulbalkan HC, Uzun A, Keskin S. Evaluating CH/N Separation Performances of Hundreds of Thousands of Real and Hypothetical MOFs by Harnessing Molecular Modeling and Machine Learning. Acs Applied Materials & Interfaces. PMID 38082488 DOI: 10.1021/acsami.3c13533  0.431
2023 Aksu GO, Keskin S. Advancing CH/H separation with covalent organic frameworks by combining molecular simulations and machine learning. Journal of Materials Chemistry. A. 11: 14788-14799. PMID 37441278 DOI: 10.1039/d3ta02433d  0.404
2023 Habib N, Durak O, Gulbalkan HC, Aydogdu AS, Keskin S, Uzun A. Composite of MIL-101(Cr) with a Pyrrolidinium-Based Ionic Liquid Providing High CO Selectivity. Acs Applied Engineering Materials. 1: 1473-1481. PMID 37383730 DOI: 10.1021/acsaenm.3c00010  0.367
2023 Daglar H, Gulbalkan HC, Habib N, Durak O, Uzun A, Keskin S. Integrating Molecular Simulations with Machine Learning Guides in the Design and Synthesis of [BMIM][BF]/MOF Composites for CO/N Separation. Acs Applied Materials & Interfaces. 15: 17421-17431. PMID 36972354 DOI: 10.1021/acsami.3c02130  0.31
2023 Aydin S, Altintas C, Erucar I, Keskin S. Computational Investigation of Dual Filler-Incorporated Polymer Membranes for Efficient CO and H Separation: MOF/COF/Polymer Mixed Matrix Membranes. Industrial & Engineering Chemistry Research. 62: 2924-2936. PMID 36812129 DOI: 10.1021/acs.iecr.2c04500  0.387
2022 Demir H, Keskin S. Computational investigation of multifunctional MOFs for adsorption and membrane-based separation of CF/CH, CH/H, CH/N, and N/H mixtures. Molecular Systems Design & Engineering. 7: 1707-1721. PMID 36561661 DOI: 10.1039/d2me00130f  0.362
2022 Daglar H, Keskin S. Combining Machine Learning and Molecular Simulations to Unlock Gas Separation Potentials of MOF Membranes and MOF/Polymer MMMs. Acs Applied Materials & Interfaces. PMID 35818710 DOI: 10.1021/acsami.2c08977  0.469
2022 Demir H, Keskin S. Multi-Level Computational Screening of Designed MOFs for Efficient SO Capture. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 126: 9875-9888. PMID 35747510 DOI: 10.1021/acs.jpcc.2c00227  0.37
2022 Osterrieth JWM, Rampersad J, Madden D, Rampal N, Skoric L, Connolly B, Allendorf MD, Stavila V, Snider JL, Ameloot R, Marreiros J, Ania C, Azevedo D, Vilarrasa-Garcia E, Santos BF, ... ... Keskin S, et al. How Reproducible are Surface Areas Calculated from the BET Equation? Advanced Materials (Deerfield Beach, Fla.). e2201502. PMID 35603497 DOI: 10.1002/adma.202201502  0.425
2022 Aydin S, Altintas C, Keskin S. High-Throughput Screening of COF Membranes and COF/Polymer MMMs for Helium Separation and Hydrogen Purification. Acs Applied Materials & Interfaces. 14: 21738-21749. PMID 35481770 DOI: 10.1021/acsami.2c04016  0.407
2021 Altundal OF, Haslak ZP, Keskin S. Combined GCMC, MD, and DFT Approach for Unlocking the Performances of COFs for Methane Purification. Industrial & Engineering Chemistry Research. 60: 12999-13012. PMID 34526735 DOI: 10.1021/acs.iecr.1c01742  0.392
2021 Daglar H, Erucar I, Keskin S. Recent advances in simulating gas permeation through MOF membranes. Materials Advances. 2: 5300-5317. PMID 34458845 DOI: 10.1039/d1ma00026h  0.36
2021 Avci G, Altintas C, Keskin S. Metal Exchange Boosts the CO Selectivity of Metal Organic Frameworks Having Zn-Oxide Nodes. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 125: 17311-17322. PMID 34413923 DOI: 10.1021/acs.jpcc.1c03630  0.356
2021 Demir H, Keskin S. Zr-MOFs for CF/CH, CH/H, and CH/N separation: towards the goal of discovering stable and effective adsorbents. Molecular Systems Design & Engineering. 6: 627-642. PMID 34381619 DOI: 10.1039/d1me00060h  0.342
2021 Daglar H, Gulbalkan HC, Avci G, Aksu GO, Altundal OF, Altintas C, Erucar I, Keskin S. Effect of MOF Database Selection on the Assessment of Gas Storage and Separation Potentials of MOFs. Angewandte Chemie (International Ed. in English). PMID 33443312 DOI: 10.1002/anie.202015250  0.402
2021 Daglar H, Erucar I, Keskin S. Exploring the performance limits of MOF/polymer MMMs for O2/N2 separation using computational screening Journal of Membrane Science. 618: 118555. DOI: 10.1016/J.Memsci.2020.118555  0.448
2021 Zeeshan M, Yalcin K, Oztuna FES, Unal U, Keskin S, Uzun A. A new class of porous materials for efficient CO2 separation: Ionic liquid/graphene aerogel composites Carbon. 171: 79-87. DOI: 10.1016/J.Carbon.2020.08.079  0.45
2020 Aksu GO, Daglar H, Altintas C, Keskin S. Computational Selection of High-Performing Covalent Organic Frameworks for Adsorption and Membrane-Based CO/H Separation. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 124: 22577-22590. PMID 33133330 DOI: 10.1021/Acs.Jpcc.0C07062  0.517
2020 Avci G, Erucar I, Keskin S. Do New MOFs Perform Better for CO Capture and H Purification? Computational Screening of the Updated MOF Database. Acs Applied Materials & Interfaces. PMID 32818375 DOI: 10.1021/Acsami.0C12330  0.493
2020 Durak O, Kulak H, Kavak S, Polat HM, Keskin S, Uzun A. Towards complete elucidation of structural factors controlling thermal stability of IL/MOF composites: Effects of ligand functionalization on MOFs. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 32590364 DOI: 10.1088/1361-648X/Aba06C  0.306
2020 Erucar I, Keskin S. Unlocking the Effect of HO on CO Separation Performance of Promising MOFs Using Atomically Detailed Simulations. Industrial & Engineering Chemistry Research. 59: 3141-3152. PMID 32201455 DOI: 10.1021/Acs.Iecr.9B05487  0.521
2020 Altundal OF, Altintas C, Keskin S. Can COFs replace MOFs in flue gas separation? high-throughput computational screening of COFs for CO2/N2 separation Journal of Materials Chemistry. 8: 14609-14623. DOI: 10.1039/D0Ta04574H  0.554
2020 Keskin S. Screening for selectivity Nature Energy. 5: 1-2. DOI: 10.1038/S41560-019-0514-Z  0.424
2020 Kavak S, Kulak H, Polat HM, Keskin S, Uzun A. Fast and Selective Adsorption of Methylene Blue from Water Using [BMIM][PF6]-Incorporated UiO-66 and NH2-UiO-66 Crystal Growth & Design. 20: 3590-3595. DOI: 10.1021/Acs.Cgd.0C00309  0.377
2020 Zeeshan M, Kulak H, Kavak S, Polat HM, Durak O, Keskin S, Uzun A. Influence of anion size and electronic structure on the gas separation performance of ionic liquid/ZIF-8 composites Microporous and Mesoporous Materials. 306: 110446. DOI: 10.1016/J.Micromeso.2020.110446  0.395
2020 Polat HM, Kavak S, Kulak H, Uzun A, Keskin S. CO2 separation from flue gas mixture using [BMIM][BF4]/MOF composites: Linking high-throughput computational screening with experiments Chemical Engineering Journal. 394: 124916. DOI: 10.1016/J.Cej.2020.124916  0.504
2020 Daglar H, Keskin S. Recent advances, opportunities, and challenges in high-throughput computational screening of MOFs for gas separations Coordination Chemistry Reviews. 422: 213470. DOI: 10.1016/J.Ccr.2020.213470  0.491
2019 Kulak H, Polat HM, Kavak S, Keskin S, Uzun A. Improving CO Separation Performance of MIL-53(Al) by Incorporating 1--Butyl-3-Methylimidazolium Methyl Sulfate. Energy Technology (Weinheim, Germany). 7: 1900157. PMID 32140382 DOI: 10.1002/Ente.201900157  0.408
2019 Kavak S, Polat HM, Kulak H, Keskin S, Uzun A. MIL-53(Al) as a Versatile Platform for Ionic-Liquid/MOF Composites to Enhance CO Selectivity over CH and N. Chemistry, An Asian Journal. PMID 31339661 DOI: 10.1002/Asia.201900634  0.372
2019 Azar ANV, Velioglu S, Keskin S. Large-Scale Computational Screening of Metal Organic Framework (MOF) Membranes and MOF-Based Polymer Membranes for H/N Separations. Acs Sustainable Chemistry & Engineering. 7: 9525-9536. PMID 31157127 DOI: 10.1021/Acssuschemeng.9B01020  0.45
2019 Velioglu S, Keskin S. Simulation of H/CH mixture permeation through MOF membranes using non-equilibrium molecular dynamics. Journal of Materials Chemistry. A. 7: 2301-2314. PMID 30931122 DOI: 10.1039/C8Ta10167A  0.541
2019 Altintas C, Velioglu S, Keskin S. Reply to Comment on 'Database for CO2 Separation Performances of MOFs Based on Computational Materials Screening'. Acs Applied Materials & Interfaces. PMID 30920197 DOI: 10.1021/Acsami.9B02614  0.381
2019 Gulsoy Z, Sezginel KB, Uzun A, Keskin S, Yildirim R. Analysis of CH4 uptake over MOFs using data mining tools. Acs Combinatorial Science. PMID 30821957 DOI: 10.1021/Acscombsci.8B00150  0.381
2019 Altintas C, Keskin S. Molecular Simulations of MOF Membranes and Performance Predictions of MOF/Polymer Mixed Matrix Membranes for CO/CH Separations. Acs Sustainable Chemistry & Engineering. 7: 2739-2750. PMID 30701144 DOI: 10.1021/Acssuschemeng.8B05832  0.509
2019 Altintas C, Avci G, Daglar H, Nemati Vesali Azar A, Erucar I, Velioglu S, Keskin S. An extensive comparative analysis of two MOF databases: high-throughput screening of computation-ready MOFs for CH4 and H2 adsorption Journal of Materials Chemistry A. 7: 9593-9608. DOI: 10.1039/C9Ta01378D  0.443
2019 Avci G, Velioglu S, Keskin S. In Silico Design of Metal Organic Frameworks with Enhanced CO2 Separation Performances: Role of Metal Sites Journal of Physical Chemistry C. 123: 28255-28265. DOI: 10.1021/Acs.Jpcc.9B08581  0.421
2019 Bac S, Keskin S, Avci AK. Recent advances in materials for high purity H2 production by ethanol and glycerol steam reforming International Journal of Hydrogen Energy. DOI: 10.1016/J.Ijhydene.2019.11.237  0.361
2019 Polat HM, Zeeshan M, Uzun A, Keskin S. Unlocking CO2 separation performance of ionic liquid/CuBTC composites: Combining experiments with molecular simulations Chemical Engineering Journal. 373: 1179-1189. DOI: 10.1016/J.Cej.2019.05.113  0.455
2019 Daglar H, Keskin S. High‐Throughput Screening of Metal Organic Frameworks as Fillers in Mixed Matrix Membranes for Flue Gas Separation Advanced Theory and Simulations. 2: 1900109. DOI: 10.1002/adts.201900109  0.316
2018 Nozari V, Zeeshan M, Keskin S, Uzun A. Effect of methylation of ionic liquids on the gas separation performance of ionic liquid/metal-organic framework composites. Crystengcomm. 20: 7137-7143. PMID 30713471 DOI: 10.1039/C8Ce01364K  0.407
2018 Ongari D, Boyd PG, Kadioglu O, Mace AK, Keskin S, Smit B. Evaluating charge equilibration methods to generate electrostatic fields in nanoporous materials. Journal of Chemical Theory and Computation. PMID 30419163 DOI: 10.1021/Acs.Jctc.8B00669  0.371
2018 Avci G, Velioglu S, Keskin S. High-Throughput Screening of MOF Adsorbents and Membranes for H Purification and CO Capture. Acs Applied Materials & Interfaces. PMID 30193065 DOI: 10.1021/Acsami.8B12746  0.514
2018 Daglar H, Keskin S. Computational Screening of Metal-Organic Frameworks for Membrane-Based CO/N/HO Separations: Best Materials for Flue Gas Separation. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 122: 17347-17357. PMID 30093931 DOI: 10.1021/Acs.Jpcc.8B05416  0.53
2018 Altintas C, Avci G, Daglar H, Gulcay E, Erucar I, Keskin S. Computer simulations of 4240 MOF membranes for H/CH separations: insights into structure-performance relations. Journal of Materials Chemistry. A. 6: 5836-5847. PMID 30009024 DOI: 10.1039/C8Ta01547C  0.536
2018 Zeeshan M, Nozari V, Yagci MB, Isık T, Unal U, Ortalan V, Keskin S, Uzun A. Core-Shell Type Ionic Liquid/Metal Organic Framework Composite: An Exceptionally High CO/CH Selectivity. Journal of the American Chemical Society. PMID 30005163 DOI: 10.1021/Jacs.8B05802  0.373
2018 Altintas C, Avci G, Daglar H, Nemati Vesali Azar A, Velioglu S, Erucar I, Keskin S. A database for CO2 Separation Performances of MOFs based on Computational Materials Screening. Acs Applied Materials & Interfaces. PMID 29722965 DOI: 10.1021/Acsami.8B04600  0.513
2018 Nemati Vesali Azar A, Keskin S. Computational Screening of MOFs for Acetylene Separation. Frontiers in Chemistry. 6: 36. PMID 29536004 DOI: 10.3389/Fchem.2018.00036  0.473
2018 Dokur D, Keskin S. Effects of Force Field Selection on the Computational Ranking of MOFs for COSeparations. Industrial & Engineering Chemistry Research. 57: 2298-2309. PMID 29503503 DOI: 10.1021/Acs.Iecr.7B04792  0.409
2018 Altintas C, Erucar I, Keskin S. High-throughput Computational Screening of the MOF Database for CH4/H2 Separations. Acs Applied Materials & Interfaces. PMID 29313343 DOI: 10.1021/Acsami.7B18037  0.539
2018 Erucar I, Keskin S. High-Throughput Molecular Simulations of Metal Organic Frameworks for CO2 Separation: Opportunities and Challenges Frontiers in Materials. 5. DOI: 10.3389/Fmats.2018.00004  0.459
2018 Kadioglu O, Keskin S. Efficient separation of helium from methane using MOF membranes Separation and Purification Technology. 191: 192-199. DOI: 10.1016/J.Seppur.2017.09.031  0.529
2018 Zeeshan M, Keskin S, Uzun A. Enhancing CO2/CH4 and CO2/N2 separation performances of ZIF-8 by post-synthesis modification with [BMIM][SCN] Polyhedron. 155: 485-492. DOI: 10.1016/J.Poly.2018.08.073  0.451
2017 Erucar I, Keskin S. Computational investigation of metal organic frameworks for storage and delivery of anticancer drugs. Journal of Materials Chemistry. B. 5: 7342-7351. PMID 32264184 DOI: 10.1039/C7Tb01764B  0.382
2017 Altintas C, Keskin S. Molecular simulations of MOF membranes for separation of ethane/ethene and ethane/methane mixtures. Rsc Advances. 7: 52283-52295. PMID 29308193 DOI: 10.1039/C7Ra11562H  0.497
2017 Kinik P, Uzun A, Keskin S. Ionic Liquid/Metal Organic Framework Composites: From Synthesis to Applications. Chemsuschem. PMID 28556605 DOI: 10.1002/Cssc.201700716  0.438
2017 Koyuturk B, Altintas C, Kinik FP, Keskin S, Uzun A. Improving Gas Separation Performance of ZIF-8 by [BMIM][BF4] Incorporation: Interactions and Their Consequences on Performance The Journal of Physical Chemistry C. 121: 10370-10381. DOI: 10.1021/Acs.Jpcc.7B00848  0.427
2017 Sumer Z, Keskin S. Adsorption- and Membrane-Based CH4/N2 Separation Performances of MOFs Industrial & Engineering Chemistry Research. 56: 8713-8722. DOI: 10.1021/Acs.Iecr.7B01809  0.558
2017 Sumer Z, Keskin S. Molecular simulations of MOF adsorbents and membranes for noble gas separations Chemical Engineering Science. 164: 108-121. DOI: 10.1016/J.Ces.2017.02.010  0.536
2016 Kinik FP, Altintas C, Balci V, Koyuturk B, Uzun A, Keskin S. [BMIM][PF6] Incorporation Doubles CO2 Selectivity of ZIF-8: Elucidation of Interactions and Their Consequences on Performance. Acs Applied Materials & Interfaces. PMID 27783899 DOI: 10.1021/Acsami.6B11087  0.501
2016 Erucar I, Keskin S. Computational Methods for MOF/Polymer Membranes. Chemical Record (New York, N.Y.). PMID 26842308 DOI: 10.1002/Tcr.201500275  0.369
2016 Sezginel KB, Keskin S, Uzun A. Tuning gas separation performance of CuBTC by ionic liquid incorporation. Langmuir : the Acs Journal of Surfaces and Colloids. PMID 26741463 DOI: 10.1021/Acs.Langmuir.5B04123  0.48
2016 Sumer Z, Keskin S. Computational Screening of MOF-Based Mixed Matrix Membranes for CO2/N2Separations Journal of Nanomaterials. 2016: 1-12. DOI: 10.1155/2016/6482628  0.426
2016 Sumer Z, Keskin S. Ranking of MOF Adsorbents for CO2 Separations: A Molecular Simulation Study Industrial & Engineering Chemistry Research. 55: 10404-10419. DOI: 10.1021/Acs.Iecr.6B02585  0.515
2016 Erucar I, Keskin S. Efficient Storage of Drug and Cosmetic Molecules in Biocompatible Metal Organic Frameworks: A Molecular Simulation Study Industrial and Engineering Chemistry Research. 55: 1929-1939. DOI: 10.1021/Acs.Iecr.5B04556  0.367
2016 Gurdal Y, Keskin S. A new approach for predicting gas separation performances of MOF membranes Journal of Membrane Science. 519: 45-54. DOI: 10.1016/J.Memsci.2016.07.039  0.457
2016 Erucar I, Keskin S. Computational assessment of MOF membranes for CH4/H2 separations Journal of Membrane Science. 514: 313-321. DOI: 10.1016/J.Memsci.2016.04.070  0.529
2016 Altintas C, Keskin S. Computational screening of MOFs for C2H6/C2H4 and C2H6/CH4 separations Chemical Engineering Science. 139: 49-60. DOI: 10.1016/J.Ces.2015.09.019  0.528
2015 Adatoz E, Keskin S. Application of MD simulations to predict membrane properties of MOFs Journal of Nanomaterials. 2015. DOI: 10.1155/2015/136867  0.491
2015 Altintas C, Keskin S. Molecular simulations of porous coordination network-based mixed matrix membranes for CO2/N2 separations Molecular Simulation. 41: 1396-1408. DOI: 10.1080/08927022.2015.1028933  0.487
2015 Yilmaz G, Ozcan A, Keskin S. Computational screening of ZIFs for CO2 separations Molecular Simulation. 41: 713-726. DOI: 10.1080/08927022.2014.923568  0.548
2015 Basdogan Y, Keskin S. Simulation and modelling of MOFs for hydrogen storage Crystengcomm. 17: 261-275. DOI: 10.1039/C4Ce01711K  0.386
2015 Basdogan Y, Sezginel KB, Keskin S. Identifying Highly Selective Metal Organic Frameworks for CH4/H2 Separations Using Computational Tools Industrial and Engineering Chemistry Research. 54: 8479-8491. DOI: 10.1021/Acs.Iecr.5B01901  0.573
2015 Adatoz E, Avci AK, Keskin S. Opportunities and challenges of MOF-based membranes in gas separations Separation and Purification Technology. 152: 207-237. DOI: 10.1016/J.Seppur.2015.08.020  0.44
2015 Günay G, Yeşilel OZ, Erer H, Keskin S, Tabak A. A zinc(II) metal organic framework based on flexible o-phenylenediacetate and rigid 4,4′-azobis(pyridine) ligands: Synthesis, crystal structure and hydrogen gas adsorption property Polyhedron. 100: 108-113. DOI: 10.1016/J.Poly.2015.07.017  0.36
2015 Demir S, Çepni HM, Topcu Y, Hołyńska M, Keskin S. A phytochemical-containing metal–organic framework: Synthesis, characterization and molecular simulations for hydrogen adsorption Inorganica Chimica Acta. 427: 138-143. DOI: 10.1016/J.Ica.2014.12.010  0.372
2015 Erucar I, Keskin S. Computational Modeling of bio-MOFs for CO2/CH4 separations Chemical Engineering Science. 130: 120-128. DOI: 10.1016/J.Ces.2015.03.016  0.59
2015 Sezginel KB, Uzun A, Keskin S. Multivariable linear models of structural parameters to predict methane uptake in metal-organic frameworks Chemical Engineering Science. 124: 125-134. DOI: 10.1016/J.Ces.2014.10.034  0.431
2015 Ozcan A, Keskin S. Effects of molecular simulation parameters on predicting gas separation performance of ZIFs Journal of Chemical Technology and Biotechnology. 90: 1707-1718. DOI: 10.1002/Jctb.4482  0.557
2014 Erucar I, Manz TA, Keskin S. Effects of electrostatic interactions on gas adsorption and permeability of MOF membranes Molecular Simulation. 40: 557-570. DOI: 10.1080/08927022.2013.829219  0.765
2014 Ozturk TN, Keskin S. Computational screening of porous coordination networks for adsorption and membrane-based gas separations Journal of Physical Chemistry C. 118: 13988-13997. DOI: 10.1021/Jp5033977  0.571
2014 Uzun A, Keskin S. Site characteristics in metal organic frameworks for gas adsorption Progress in Surface Science. 89: 56-79. DOI: 10.1016/J.Progsurf.2013.11.001  0.481
2014 Yilmaz G, Keskin S. Molecular modeling of MOF and ZIF-filled MMMs for CO2/N2 separations Journal of Membrane Science. 454: 407-417. DOI: 10.1016/J.Memsci.2013.12.045  0.481
2014 Erer H, Yeşilel OZ, Arici M, Keskin S, Büyükgüngör O. 2D→3D polycatenated and 3D→3D interpenetrated metal-organic frameworks constructed from thiophene-2,5-dicarboxylate and rigid bis(imidazole) ligands Journal of Solid State Chemistry. 210: 261-266. DOI: 10.1016/J.Jssc.2013.11.036  0.303
2014 Arici M, Yeşilel OZ, Keskin S, Şahin O. Gas adsorption/separation properties of metal directed self-assembly of two coordination polymers with 5-nitroisophthalate Journal of Solid State Chemistry. 210: 280-286. DOI: 10.1016/J.Jssc.2013.11.010  0.344
2013 Erucar I, Yilmaz G, Keskin S. Recent advances in metal-organic framework-based mixed matrix membranes. Chemistry, An Asian Journal. 8: 1692-704. PMID 23526663 DOI: 10.1002/Asia.201300084  0.483
2013 Keskin S. Gas adsorption and diffusion in a highly CO 2 selective metal-organic framework: Molecular simulations Molecular Simulation. 39: 14-24. DOI: 10.1080/08927022.2012.700485  0.552
2013 Arici M, Yeşılel OZ, Keskın S, Şahın O, Büyükgüngör O. The synthesis, characterization, and theoretical hydrogen gas adsorption properties of copper(II)-3,3′-thiodipropionate complexes with imidazole derivatives Journal of Coordination Chemistry. 66: 4093-4106. DOI: 10.1080/00958972.2013.860223  0.319
2013 Gurdal Y, Keskin S. Predicting noble gas separation performance of metal organic frameworks using theoretical correlations Journal of Physical Chemistry C. 117: 5229-5241. DOI: 10.1021/Jp312838V  0.476
2013 Ozturk TN, Keskin S. Predicting gas separation performances of porous coordination networks using atomistic simulations Industrial and Engineering Chemistry Research. 52: 17627-17639. DOI: 10.1021/Ie403159C  0.574
2013 Erucar I, Keskin S. High CO2 selectivity of an amine-functionalized metal organic framework in adsorption-based and membrane-based gas separations Industrial and Engineering Chemistry Research. 52: 3462-3472. DOI: 10.1021/Ie303343M  0.57
2013 Semerci F, Yeşilel OZ, Soylu MS, Keskin S, Büyükgüngör O. A two-dimensional photoluminescent cadmium(II) coordination polymer containing a new coordination mode of pyridine-2,3-dicarboxylate: Synthesis, structure and molecular simulations for gas storage and separation applications Polyhedron. 50: 314-320. DOI: 10.1016/J.Poly.2012.10.009  0.321
2013 Ulker Z, Erucar I, Keskin S, Erkey C. Novel nanostructured composites of silica aerogels with a metal organic framework Microporous and Mesoporous Materials. 170: 352-358. DOI: 10.1016/J.Micromeso.2012.11.040  0.31
2013 Günay G, Yeşilel OZ, Darcan C, Keskin S, Büyükgüngör O. Synthesis, crystal structures, molecular simulations for hydrogen gas adsorption, fluorescent and antimicrobial properties of pyrazine-2,3- dicarboxylate complexes Inorganica Chimica Acta. 399: 19-35. DOI: 10.1016/J.Ica.2012.12.036  0.316
2012 Yeilel OZ, Günay G, Darcan C, Soylu MS, Keskin S, Ng SW. An unusual 3D metal-organic framework, {[Ag 4(μ 4- pzdc) 2(μ-en) 2]·H 2O} n: C-H⋯Ag, N-H⋯Ag and (O-H)⋯Ag interactions and an unprecedented coordination mode for pyrazine-2,3-dicarboxylate Crystengcomm. 14: 2817-2825. DOI: 10.1039/C2Ce06603C  0.305
2012 Atci E, Keskin S. Understanding the potential of zeolite imidazolate framework membranes in gas separations using atomically detailed calculations Journal of Physical Chemistry C. 116: 15525-15537. DOI: 10.1021/Jp305684D  0.579
2012 Keskin S. Adsorption, diffusion, and separation of CH 4/H 2 mixtures in covalent organic frameworks: Molecular simulations and theoretical predictions Journal of Physical Chemistry C. 116: 1772-1779. DOI: 10.1021/Jp209804X  0.551
2012 Yilmaz G, Keskin S. Predicting the performance of zeolite imidazolate framework/polymer mixed matrix membranes for CO 2, CH 4, and H 2 separations using molecular simulations Industrial and Engineering Chemistry Research. 51: 14218-14228. DOI: 10.1021/Ie302290A  0.525
2012 Gurdal Y, Keskin S. Atomically detailed modeling of metal organic frameworks for adsorption, diffusion, and separation of noble gas mixtures Industrial and Engineering Chemistry Research. 51: 7373-7382. DOI: 10.1021/Ie300766S  0.498
2012 Atci E, Keskin S. Atomically detailed models for transport of gas mixtures in ZIF membranes and ZIF/polymer composite membranes Industrial and Engineering Chemistry Research. 51: 3091-3100. DOI: 10.1021/Ie202530F  0.533
2012 Arici M, Yeşilel OZ, Keskin S, Taş M. A three-dimensional silver(I) framework assembled from 3,3′- thiodipropionate: Synthesis, structure and molecular simulations for hydrogen gas adsorption Polyhedron. 45: 103-106. DOI: 10.1016/J.Poly.2012.07.060  0.324
2012 Erucar I, Keskin S. Computational screening of metal organic frameworks for mixed matrix membrane applications Journal of Membrane Science. 407: 221-230. DOI: 10.1016/J.Memsci.2012.03.050  0.496
2012 Karakaya M, Keskin S, Avci AK. Parametric study of methane steam reforming to syngas in a catalytic microchannel reactor Applied Catalysis a: General. 411: 114-122. DOI: 10.1016/J.Apcata.2011.10.028  0.313
2011 Erucar I, Keskin S. Separation of CO2 mixtures using Zn(bdc)(ted)0.5 membranes and composites: A molecular simulation study Journal of Physical Chemistry C. 115: 13637-13644. DOI: 10.1021/Jp203522U  0.551
2011 Liu J, Keskin S, Sholl DS, Johnson JK. Molecular simulations and theoretical predictions for adsorption and diffusion of CH4/H2 and CO2/CH4 mixtures in ZIFs Journal of Physical Chemistry C. 115: 12560-12566. DOI: 10.1021/Jp203053H  0.608
2011 Atci E, Erucar I, Keskin S. Adsorption and transport of CH4, CO2, H2 mixtures in a bio-MOF material from molecular simulations Journal of Physical Chemistry C. 115: 6833-6840. DOI: 10.1021/Jp200429X  0.572
2011 Keskin S. Atomistic simulations for adsorption, diffusion, and separation of gas mixtures in zeolite imidazolate frameworks Journal of Physical Chemistry C. 115: 800-807. DOI: 10.1021/Jp109743E  0.575
2011 Erucar I, Keskin S. Screening metal-organic framework-based mixed-matrix membranes for CO 2/CH4 separations Industrial and Engineering Chemistry Research. 50: 12606-12616. DOI: 10.1021/Ie201885S  0.483
2011 Keskin S. High CO2 selectivity of a microporous metal-imidazolate framework: A molecular simulation study Industrial and Engineering Chemistry Research. 50: 8230-8236. DOI: 10.1021/Ie200540Y  0.533
2011 Keskin S, Kizilel S. Biomedical Applications of Metal Organic Frameworks Industrial and Engineering Chemistry Research. 50: 1799-1812. DOI: 10.1021/Ie101312K  0.369
2011 Günay G, Yeşilel OZ, Soylu MS, Keskin S, Dal H. Two novel 2D and 3D coordination polymers constructed from pyrazine-2,3-dicarboxylic acid and chloride bridged secondary building units Synthetic Metals. 161: 2471-2480. DOI: 10.1016/J.Synthmet.2011.09.033  0.317
2010 Keskin S, van Heest TM, Sholl DS. Can metal-organic framework materials play a useful role in large-scale carbon dioxide separations? Chemsuschem. 3: 879-91. PMID 20730980 DOI: 10.1002/Cssc.201000114  0.57
2010 Keskin S, Sholl DS. Selecting metal organic frameworks as enabling materials in mixed matrix membranes for high efficiency natural gas purification Energy and Environmental Science. 3: 343-351. DOI: 10.1039/B923980B  0.632
2010 Keskin S. Molecular simulation study of CH4/H2 mixture separations using metal organic framework membranes and composites Journal of Physical Chemistry C. 114: 13047-13054. DOI: 10.1021/Jp102881E  0.502
2010 Keskin S. Comparing performance of CPO and IRMOF membranes for gas separations using atomistic models Industrial and Engineering Chemistry Research. 49: 11689-11696. DOI: 10.1021/Ie1015443  0.576
2009 Watanabe T, Keskin S, Nair S, Sholl DS. Computational identification of a metal organic framework for high selectivity membrane-based CO2/CH4 separations: Cu(hfipbb)(H2hfipbb)0.5. Physical Chemistry Chemical Physics : Pccp. 11: 11389-94. PMID 20024407 DOI: 10.1039/B918254N  0.647
2009 Keskin S, Sholl DS. Efficient methods for screening of metal organic framework membranes for gas separations using atomically detailed models. Langmuir : the Acs Journal of Surfaces and Colloids. 25: 11786-95. PMID 19572515 DOI: 10.1021/La901438X  0.67
2009 Keskin S, Sholl DS. Assessment of a metal-organic framework membrane for gas separations using atomically detailed calculations: CO 2, CH 4, N 2, H 2 mixtures in MOF-5 Industrial and Engineering Chemistry Research. 48: 914-922. DOI: 10.1021/Ie8010885  0.662
2009 Keskin S, Liu J, Rankin RB, Johnson JK, Sholl DS. Progress, opportunities, and challenges for applying atomically detailed modeling to molecular adsorption and transport in metal - Organic framework materials Industrial and Engineering Chemistry Research. 48: 2355-2371. DOI: 10.1021/Ie800666S  0.727
2009 Keskin S, Liu J, Johnson JK, Sholl DS. Atomically detailed models of gas mixture diffusion through CuBTC membranes Microporous and Mesoporous Materials. 125: 101-106. DOI: 10.1016/J.Micromeso.2009.01.016  0.669
2008 Keskin S, Liu J, Johnson JK, Sholl DS. Testing the accuracy of correlations for multicomponent mass transport of adsorbed gases in metal-organic frameworks: diffusion of H2/CH4 mixtures in CuBTC. Langmuir : the Acs Journal of Surfaces and Colloids. 24: 8254-61. PMID 18613712 DOI: 10.1021/La800486F  0.587
2008 Johnson K, Liu J, Keskin S, Sholl DS. Molecular modeling study of adsorption and diffusion of mixed gases in cubtc metal organic framework 2008 Aiche Spring National Meeting, Conference Proceedings 0.515
2008 Keskin S, Sholl DS. Screening of metal organic framework based membranes for carbon dioxide separations using atomically detailed simulations Aiche Annual Meeting, Conference Proceedings 0.5
2007 Keskin S, Sholl DS. Screening metal-organic framework materials for membrane-based methane/carbon dioxide separations Journal of Physical Chemistry C. 111: 14055-14059. DOI: 10.1021/Jp075290L  0.616
2007 Keskin S, Kayrak-Talay D, Akman U, Hortaçsu O. A review of ionic liquids towards supercritical fluid applications Journal of Supercritical Fluids. 43: 150-180. DOI: 10.1016/J.Supflu.2007.05.013  0.302
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