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Yamil J. Colón, PhD - Publications

Affiliations: 
2005-2009 Chemical and Biomolecular Engineering University of Notre Dame, Notre Dame, IN, United States 
 2010-2015 Chemical and Biological Engineering Northwestern University, Evanston, IL 
 2015- IME University of Chicago, Chicago, IL 
Area:
Molecular Modeling
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25 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 Carpenter JE, Colón YJ. Atomistic simulation of soft porous coordination polymers. The Journal of Chemical Physics. 158: 074901. PMID 36813721 DOI: 10.1063/5.0131179  0.336
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, 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  0.713
2020 Ma R, Colon YJ, Luo T. A Transfer Learning Study of Gas Adsorption in Metal-Organic Frameworks. Acs Applied Materials & Interfaces. PMID 32613831 DOI: 10.1021/Acsami.0C06858  0.322
2020 Chu W, Webb MA, Deng C, Colón YJ, Kambe Y, Krishnan S, Nealey PF, de Pablo JJ. Understanding Ion Mobility in P2VP/NMP+I– Polymer Electrolytes: A Combined Simulation and Experimental Study Macromolecules. 53: 2783-2792. DOI: 10.1021/Acs.Macromol.9B02329  0.713
2019 Sturluson A, Huynh MT, Kaija AR, Laird C, Yoon S, Hou F, Feng Z, Wilmer CE, Colón YJ, Chung YG, Siderius DW, Simon CM. The role of molecular modelling and simulation in the discovery and deployment of metal-organic frameworks for gas storage and separation. Molecular Simulation. 45. PMID 31579352 DOI: 10.1080/08927022.2019.1648809  0.762
2019 Colón YJ, Snurr RQ. The effect of co-adsorbed solvent molecules on H binding to metal alkoxides. Physical Chemistry Chemical Physics : Pccp. PMID 30994123 DOI: 10.1039/C9Cp00754G  0.565
2019 Colón YJ, Guo AZ, Antony LW, Hoffmann KQ, de Pablo JJ. Free energy of metal-organic framework self-assembly. The Journal of Chemical Physics. 150: 104502. PMID 30876355 DOI: 10.1063/1.5063588  0.509
2018 Wu Q, Zhao D, Goldey MB, Filatov AS, Sharapov V, Colon YJ, Cai Z, Chen W, de Pablo JJ, Galli G, Yu L. Intra-molecular Charge Transfer and Electron Delocalization in Non-Fullerene Organic Solar Cells. Acs Applied Materials & Interfaces. PMID 29498504 DOI: 10.1021/Acsami.7B18717  0.465
2018 Sidky H, Colón YJ, Helfferich J, Sikora BJ, Bezik C, Chu W, Giberti F, Guo AZ, Jiang X, Lequieu J, Li J, Moller J, Quevillon MJ, Rahimi M, Ramezani-Dakhel H, et al. SSAGES: Software Suite for Advanced General Ensemble Simulations. The Journal of Chemical Physics. 148: 044104. PMID 29390830 DOI: 10.1063/1.5008853  0.722
2017 Colón YJ, Gómez-Gualdrón DA, Snurr RQ. Topologically Guided, Automated Construction of Metal–Organic Frameworks and Their Evaluation for Energy-Related Applications Crystal Growth & Design. 17: 5801-5810. DOI: 10.1021/Acs.Cgd.7B00848  0.579
2016 Gómez-Gualdrón DA, Colón YJ, Zhang X, Wang TC, Chen Y, Hupp JT, Yildirim T, Farha OK, Zhang J, Snurr RQ. Evaluating topologically diverse metal–organic frameworks for cryo-adsorbed hydrogen storage Energy & Environmental Science. 9: 3279-3289. DOI: 10.1039/C6Ee02104B  0.575
2015 Chakraborty S, Colón YJ, Snurr RQ, Nguyen ST. Hierarchically porous organic polymers: highly enhanced gas uptake and transport through templated synthesis. Chemical Science. 6: 384-389. PMID 28966764 DOI: 10.1039/C4Sc02502D  0.568
2015 Sikora BJ, Colón YJ, Snurr RQ. Continuous fractional component Monte Carlo simulations of high-density adsorption in metal–organic frameworks Molecular Simulation. DOI: 10.1080/08927022.2015.1043629  0.683
2015 Chakraborty S, Colón YJ, Snurr RQ, Nguyen ST. Hierarchically porous organic polymers: Highly enhanced gas uptake and transport through templated synthesis Chemical Science. 6: 384-389. DOI: 10.1039/c4sc02502d  0.456
2014 Ghosh P, Colón YJ, Snurr RQ. Water adsorption in UiO-66: the importance of defects. Chemical Communications (Cambridge, England). 50: 11329-31. PMID 25116653 DOI: 10.1039/C4Cc04945D  0.637
2014 Colón YJ, Snurr RQ. High-throughput computational screening of metal-organic frameworks. Chemical Society Reviews. 43: 5735-49. PMID 24777001 DOI: 10.1039/C4Cs00070F  0.591
2014 Weston MH, Colón YJ, Bae YS, Garibay SJ, Snurr RQ, Farha OK, Hupp JT, Nguyen ST. High propylene/propane adsorption selectivity in a copper(catecholate)- decorated porous organic polymer Journal of Materials Chemistry A. 2: 299-302. DOI: 10.1039/C3Ta12999C  0.688
2014 Colón YJ, Fairen-Jimenez D, Wilmer CE, Snurr RQ. High-throughput screening of porous crystalline materials for hydrogen storage capacity near room temperature Journal of Physical Chemistry C. 118: 5383-5389. DOI: 10.1021/Jp4122326  0.75
2014 Colón YJ, Krishna R, Snurr RQ. Strong influence of the H2 binding energy on the Maxwell-Stefan diffusivity in NU-100, UiO-68, and IRMOF-16 Microporous and Mesoporous Materials. 185: 190-196. DOI: 10.1016/J.Micromeso.2013.10.031  0.545
2013 Katz MJ, Brown ZJ, Colón YJ, Siu PW, Scheidt KA, Snurr RQ, Hupp JT, Farha OK. A facile synthesis of UiO-66, UiO-67 and their derivatives. Chemical Communications (Cambridge, England). 49: 9449-51. PMID 24008272 DOI: 10.1039/C3Cc46105J  0.47
2013 Garibay SJ, Weston MH, Mondloch JE, Colón YJ, Farha OK, Hupp JT, Nguyen ST. Accessing functionalized porous aromatic frameworks (PAFs) through a de novo approach Crystengcomm. 15: 1515-1519. DOI: 10.1039/C2Ce26595H  0.382
2013 Brand SK, Colón YJ, Getman RB, Snurr RQ. Design strategies for metal alkoxide functionalized metal-organic frameworks for ambient temperature hydrogen storage Microporous and Mesoporous Materials. 171: 103-109. DOI: 10.1016/J.Micromeso.2012.12.020  0.729
2013 Bae YS, Hauser BG, Colón YJ, Hupp JT, Farha OK, Snurr RQ. High xenon/krypton selectivity in a metal-organic framework with small pores and strong adsorption sites Microporous and Mesoporous Materials. 169: 176-179. DOI: 10.1016/J.Micromeso.2012.11.013  0.718
2013 Colón YJ, Brand SK, Snurr RQ. Effect of metal alkoxide functionalization on hydrogen mobility in metal-organic frameworks Chemical Physics Letters. 577: 76-81. DOI: 10.1016/J.Cplett.2013.05.021  0.566
2012 Fairen-Jimenez D, Colón YJ, Farha OK, Bae YS, Hupp JT, Snurr RQ. Understanding excess uptake maxima for hydrogen adsorption isotherms in frameworks with rht topology. Chemical Communications (Cambridge, England). 48: 10496-8. PMID 22992582 DOI: 10.1039/C2Cc35711A  0.757
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