Show simple item record

dc.contributor.authorOsterrieth, Johannes W. M.
dc.contributor.authorRampersad, James
dc.contributor.authorMadden, David
dc.contributor.authorRampal, Nakul
dc.contributor.authorSkoric, Luka
dc.contributor.authorConnolly, Bethany
dc.contributor.authorAllendorf, Mark D.
dc.contributor.authorStavila, Vitalie
dc.contributor.authorSnider, Jonathan L.
dc.contributor.authorAmeloot, Rob
dc.contributor.authorMarreiros, João
dc.contributor.authorAnia, Conchi
dc.contributor.authorAzevedo, Diana
dc.contributor.authorVilarrasa-Garcia, Enrique
dc.contributor.authorSantos, Bianca F.
dc.contributor.authorBu, Xian-He
dc.contributor.authorChang, Ze
dc.contributor.authorBunzen, Hana
dc.contributor.authorChampness, Neil R.
dc.contributor.authorGriffin, Sarah L.
dc.contributor.authorChen, Banglin
dc.contributor.authorLin, Rui-Biao
dc.contributor.authorCoasne, Benoit
dc.contributor.authorCohen, Seth
dc.contributor.authorMoreton, Jessica C.
dc.contributor.authorColón, Yamil J.
dc.contributor.authorChen, Linjiang
dc.contributor.authorClowes, Rob
dc.contributor.authorCoudert, François-Xavier
dc.contributor.authorCui, Yong
dc.contributor.authorHou, Bang
dc.contributor.authorD'Alessandro, Deanna M.
dc.contributor.authorDoheny, Patrick W.
dc.contributor.authorDincă, Mircea
dc.contributor.authorSun, Chenyue
dc.contributor.authorDoonan, Christian
dc.contributor.authorHuxley, Michael Thomas
dc.contributor.authorEvans, Jack D.
dc.contributor.authorFalcaro, Paolo
dc.contributor.authorRicco, Raffaele
dc.contributor.authorFarha, Omar
dc.contributor.authorIdrees, Karam B.
dc.contributor.authorIslamoglu, Timur
dc.contributor.authorFeng, Pingyun
dc.contributor.authorYang, Huajun
dc.contributor.authorForgan, Ross S.
dc.contributor.authorBara, Dominic
dc.contributor.authorFurukawa, Shuhei
dc.contributor.authorSanchez, Eli
dc.contributor.authorGascon, Jorge
dc.contributor.authorTelalovic, Selvedin
dc.contributor.authorGhosh, Sujit K.
dc.contributor.authorMukherjee, Soumya
dc.contributor.authorHill, Matthew R.
dc.contributor.authorSadiq, Muhammed Munir
dc.contributor.authorHorcajada, Patricia
dc.contributor.authorSalcedo-Abraira, Pablo
dc.contributor.authorKaneko, Katsumi
dc.contributor.authorKukobat, Radovan
dc.contributor.authorKenvin, Jeff
dc.contributor.authorKeskin, Seda
dc.contributor.authorKitagawa, Susumu
dc.contributor.authorOtake, Ken-ichi
dc.contributor.authorLively, Ryan P.
dc.contributor.authorDeWitt, Stephen J. A.
dc.contributor.authorLlewellyn, Phillip
dc.contributor.authorLotsch, Bettina V.
dc.contributor.authorEmmerling, Sebastian T.
dc.contributor.authorPütz, Alexander M.
dc.contributor.authorMartí-Gastaldo, Carlos
dc.contributor.authorPadial, Natalia M.
dc.contributor.authorGarcía-Martínez, Javier
dc.contributor.authorLinares, Noemi
dc.contributor.authorMaspoch, Daniel
dc.contributor.authorSuárez del Pino, Jose A.
dc.contributor.authorMoghadam, Peyman
dc.contributor.authorOktavian, Rama
dc.contributor.authorMorris, Russel E.
dc.contributor.authorWheatley, Paul S.
dc.contributor.authorNavarro, Jorge
dc.contributor.authorPetit, Camille
dc.contributor.authorDanaci, David
dc.contributor.authorRosseinsky, Matthew J.
dc.contributor.authorKatsoulidis, Alexandros P.
dc.contributor.authorSchröder, Martin
dc.contributor.authorHan, Xue
dc.contributor.authorYang, Sihai
dc.contributor.authorSerre, Christian
dc.contributor.authorMouchaham, Georges
dc.contributor.authorSholl, David S.
dc.contributor.authorThyagarajan, Raghuram
dc.contributor.authorSiderius, Daniel
dc.contributor.authorSnurr, Randall Q.
dc.contributor.authorGoncalves, Rebecca B.
dc.contributor.authorTelfer, Shane
dc.contributor.authorLee, Seok J.
dc.contributor.authorTing, Valeska P.
dc.contributor.authorRowlandson, Jemma L.
dc.contributor.authorUemura, Takashi
dc.contributor.authorIiyuka, Tomoya
dc.contributor.authorVeen, Monique A.
dc.contributor.authorRega, Davide
dc.contributor.authorVan Speybroeck, Veronique
dc.contributor.authorRogge, Sven M. J.
dc.contributor.authorLamaire, Aran
dc.contributor.authorWalton, Krista S.
dc.contributor.authorBingel, Lukas W.
dc.contributor.authorWuttke, Stefan
dc.contributor.authorAndreo, Jacopo
dc.contributor.authorYaghi, Omar
dc.contributor.authorZhang, Bing
dc.contributor.authorYavuz, Cafer T.
dc.contributor.authorNguyen, Thien S.
dc.contributor.authorZamora, Felix
dc.contributor.authorMontoro, Carmen
dc.contributor.authorZhou, Hongcai
dc.contributor.authorKirchon, Angelo
dc.contributor.authorFairen-Jimenez, David
dc.date.accessioned2022-05-24T05:56:12Z
dc.date.available2022-05-24T05:56:12Z
dc.date.issued2022-05-23
dc.identifier.citationOsterrieth, J. W. M., Rampersad, J., Madden, D., Rampal, N., Skoric, L., Connolly, B., Allendorf, M. D., Stavila, V., Snider, J. L., Ameloot, R., Marreiros, J., Ania, C., Azevedo, D., Vilarrasa-Garcia, E., Santos, B. F., Bu, X., Chang, Z., Bunzen, H., Champness, N. R., … Fairen-Jimenez, D. (2022). How Reproducible are Surface Areas Calculated from the BET Equation? Advanced Materials, 2201502. Portico. https://doi.org/10.1002/adma.202201502
dc.identifier.issn0935-9648
dc.identifier.issn1521-4095
dc.identifier.doi10.1002/adma.202201502
dc.identifier.urihttp://hdl.handle.net/10754/678181
dc.description.abstractPorosity and surface area analysis play a prominent role in modern materials science. At the heart of this sits the Brunauer–Emmett–Teller (BET) theory, which has been a remarkably successful contribution to the field of materials science. The BET method was developed in the 1930s for open surfaces but is now the most widely used metric for the estimation of surface areas of micro- and mesoporous materials. Despite its widespread use, the calculation of BET surface areas causes a spread in reported areas, resulting in reproducibility problems in both academia and industry. To prove this, for this analysis, 18 already-measured raw adsorption isotherms were provided to sixty-one labs, who were asked to calculate the corresponding BET areas. This round-robin exercise resulted in a wide range of values. Here, the reproducibility of BET area determination from identical isotherms is demonstrated to be a largely ignored issue, raising critical concerns over the reliability of reported BET areas. To solve this major issue, a new computational approach to accurately and systematically determine the BET area of nanoporous materials is developed. The software, called “BET surface identification” (BETSI), expands on the well-known Rouquerol criteria and makes an unambiguous BET area assignment possible.
dc.description.sponsorshipThis project has received funding from the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation programme (NanoMOFdeli), ERC-2016-COG 726380, Innovate UK (104384) and EPSRC IAA (IAA/RG85685). N.R. acknowledges the support of the Cambridge International Scholarship and the Trinity-Henry Barlow Scholarship (Honorary). O.K.F. and R.Q.S. acknowledge funding from the U.S. Department of Energy (DE-FG02-08ER15967). R.S.F. and D.B. acknowledge funding from the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation programme (SCoTMOF), ERC-2015-StG 677289. Sandia National Laboratories is a multimission laboratory managed and operated by National Technology and Engineering Solutions of Sandia, LLC., a wholly owned subsidiary of Honeywell International, Inc., for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-NA-0003525. The authors gratefully acknowledge funding from the U.S. Department of Energy, Office of Energy Efficiency and Renewable Energy, Hydrogen and Fuel Cell Technologies Office, through the Hydrogen Storage Materials Advanced Research Consortium (HyMARC). This paper describes objective technical results and analysis. Any subjective views or opinions that might be expressed in the paper do not necessarily represent the views of the U.S. Department of Energy or the United States Government. J.D.E. acknowledges the support of the Alexander von Humboldt Foundation and the Center for Information Services and High Performance Computing (ZIH) at TU Dresden. S.K.G. and S.M. acknowledge SERB (Project No. CRG/2019/000906), India for financial support. K.K. and R.K. acknowledge Active Co. Research Grant for funding. S.K. acknowledges funding from the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation programme (COSMOS), ERC-2017-StG 756489. N.L. and J.G.M acknowledge funding from the European Commission through the H2020-MSCA-RISE-2019 program (ZEOBIOCHEM – 872102) and the Spanish MICINN and AEI/FEDER (RTI2018-099504-B-C21). N.L. thanks the University of Alicante for funding (UATALENTO17-05). ICN2 is supported by the Severo Ochoa program from the Spanish MINECO (Grant No. SEV-2017-0706) S.M.J.R. and A.L. wish to thank the Fund for Scientific Research Flanders (FWO), under grant nos. 12T3519N and 11D2220N. L.S. was supported by the EPSRC Cambridge NanoDTC EP/L015978/1. C.T.Y. and T.S.N. acknowledges funds from the National Research Foundation of Korea, NRF-2017M3A7B4042140 and NRF-2017M3A7B4042235. P.F. and H. Y. acknowledge US Department of Energy, Office of Basic Energy Sciences, Materials Sciences and Engineering Division under Award No. DE-SC0010596 (P.F.). R.O. would like to acknowledge funding support during his Ph.D. study from Indonesian Endowment Fund for Education-LPDP with the contract No. 202002220216006. Daniel Siderius: Official contribution of the National Institute of Standards and Technology (NIST), not subject to copyright in the United States of America. Daniel Siderius: Certain commercially available items may be identified in this paper. This identification does not imply recommendation by NIST, nor does it imply that it is the best available for the purposes described. B.V.L, S.T.E and A.M.P acknowledge funding from the European Research Council (ERC) under the European Union's Horizon 2020 Research and Innovation Program (Grant agreement no. 639233, COFLeaf).
dc.publisherWiley
dc.relation.urlhttps://onlinelibrary.wiley.com/doi/10.1002/adma.202201502
dc.rightsArchived with thanks to Advanced Materials under a Creative Commons license, details at: http://creativecommons.org/licenses/by/4.0/
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/
dc.titleHow Reproducible are Surface Areas Calculated from the BET Equation?
dc.typeArticle
dc.contributor.departmentKAUST Catalysis Center (KCC) King Abdullah University of Science and Technology P.O. Box 4700 Thuwal-Jeddah 23955-6900 Kingdom of Saudi Arabia
dc.contributor.departmentChemical Engineering Program
dc.contributor.departmentKAUST Catalysis Center (KCC)
dc.contributor.departmentPhysical Science and Engineering (PSE) Division
dc.identifier.journalAdvanced Materials
dc.eprint.versionPublisher's Version/PDF
dc.contributor.institutionThe Adsorption & Advanced Materials Laboratory (A <sup>2</sup>ML) Department of Chemical Engineering & Biotechnology University of Cambridge Philippa Fawcett Drive Cambridge CB3 0AS UK
dc.contributor.institutionCavendish Laboratory University of Cambridge JJ Thomson Avenue Cambridge CB3 0HE UK
dc.contributor.institutionSandia National Laboratories 7011 East Avenue Livermore CA 94550 USA
dc.contributor.institutioncMACS Department of Microbial and Molecular Systems (M <sup>2</sup>S) KU Leuven Leuven 3001 Belgium
dc.contributor.institutionCEMHTI CNRS (UPR 3079) Université d'Orléans Orléans 45071 France
dc.contributor.institutionLPACO2/GPSA Department of Chemical Engineering Federal University of Ceará Fortaleza (CE) 60455-760 Brazil
dc.contributor.institutionSchool of Materials Science and Engineering National Institute for Advanced Materials Nankai University Tianjin 300350 China
dc.contributor.institutionChair of Solid State and Materials Chemistry Institute of Physics University of Augsburg Universitaetsstrasse 1 86159 Augsburg Germany
dc.contributor.institutionSchool of Chemistry University of Nottingham University Park Nottingham NG7 2RD UK
dc.contributor.institutionDepartment of Chemistry University of Texas at San Antonio One UTSA Circle San Antonio TX 78249-0698 USA
dc.contributor.institutionUniv. Grenoble Alpes CNRS LIPhy Grenoble 38000 France
dc.contributor.institutionDepartment of Chemistry and Biochemistry University of California San Diego La Jolla CA 92093 USA
dc.contributor.institutionDepartment of Chemical and Biomolecular Engineering University of Notre Dame Notre Dame IN 46556 USA
dc.contributor.institutionLeverhulme Research Centre for Functional Materials Design Materials Innovation Factory and Department of Chemistry University of Liverpool Liverpool L7 3NY UK
dc.contributor.institutionChimie ParisTech PSL University CNRS Institut de Recherche de Chimie Paris Paris 75005 France
dc.contributor.institutionSchool of Chemistry and Chemical Engineering Shanghai Jiaotong University 800 Dongchuan Road, Minhang District Shanghai 200240 China
dc.contributor.institutionSchool of Chemistry The University of Sydney New South Wales 2006 Australia
dc.contributor.institutionDepartment of Chemistry Massachusetts Institute of Technology Cambridge MA 02139 USA
dc.contributor.institutionCentre for Advanced Nanomaterials and Department of Chemistry The University of Adelaide North Terrace Adelaide SA 5000 Australia
dc.contributor.institutionDepartment of Inorganic Chemistry Technische Universität Dresden Bergstrasse 66 01062 Dresden Germany
dc.contributor.institutionInstitute of Physical and Theoretical Chemistry Graz University of Technology Graz 8010 Austria
dc.contributor.institutionDepartment of Chemistry and International Institute of Nanotechnology Northwestern University 2145 Sheridan Road Evanston IL 60208 USA
dc.contributor.institutionDepartment of Chemistry University of California Riverside CA 92521 USA
dc.contributor.institutionWestCHEM, School of Chemistry University of Glasgow Glasgow G12 8QQ UK
dc.contributor.institutionInstitute for Integrated Cell-Material Sciences Kyoto University Yoshida, Sakyo-ku Kyoto 606-8501 Japan
dc.contributor.institutionDepartment of Chemistry Indian Institute of Science Education and Research (IISER) Pune Dr. Homi Bhabha Road, Pashan Pune 411008 India
dc.contributor.institutionCSIRO Private Bag 33, Clayton South MDC Clayton VIC 3169 Australia
dc.contributor.institutionDepartment of Chemical Engineering Monash University Clayton VIC 3168 Australia
dc.contributor.institutionAdvanced Porous Materials Unit (APMU) IMDEA Energy Avda. Ramón de la Sagra 3 (Móstoles) Madrid E-28935 Spain
dc.contributor.institutionResearch Initiative for Supra-Materials Shinshu University Nagano 380-8553 Japan
dc.contributor.institutionMicromeritics Instrument Corporation Norcross GA 30093 USA
dc.contributor.institutionDepartment of Chemical and Biological Engineering Koc University Rumelifeneri Yolu Sariyer Istanbul 34450 Turkey
dc.contributor.institutionInstitute for Integrated Cell-Material Sciences (WPI-iCeMS) Kyoto University Institute for Advanced Study (KUIAS) Kyoto University Yoshida Ushinomiya-cho, Sakyo-ku Kyoto 606-8501 Japan
dc.contributor.institutionSchool of Chemical & Biomolecular Engineering Georgia Institute of Technology Atlanta GA 30332 USA
dc.contributor.institutionCNRS / Aix-Marseille Univ./Total Marseille 64018 France
dc.contributor.institutionMax Planck Institute for Solid State Research Heisenbergstrasse 1 70569 Stuttgart Germany
dc.contributor.institutionDepartment of Chemistry University of Munich (LMU) Butenandtstrasse 5-13 81377 Munich Germany
dc.contributor.institutionInstituto de Ciencia Molecular (ICMol) Universitat de València Paterna València 46980 Spain
dc.contributor.institutionLaboratorio de Nanotecnología Molecular Departamento de Química Inorgánica Universidad de Alicante Ctra. San Vicente-Alicante s/n San Vicente del Raspeig E-03690 Spain
dc.contributor.institutionICREA Pg. Lluís Companys 23 Barcelona 08010 Spain
dc.contributor.institutionCatalan Institute of Nanoscience and Nanotechnology (ICN2) CSIC and the Barcelona Institute of Science and Technology Campus UAB, Bellaterra Barcelona 08193 Spain
dc.contributor.institutionDepartment of Chemical and Biological Engineering The University of Sheffield Sheffield S10 2TN UK
dc.contributor.institutionSchool of Chemistry University of St Andrews North Haugh St Andrews KY16 9ST UK
dc.contributor.institutionDepartamento de Química Inorgánica Universidad de Granada Granada 18071 Spain
dc.contributor.institutionBarrer Centre Department of Chemical Engineering Imperial College London London SW7 2AZ UK
dc.contributor.institutionMaterials Innovation Factory Department of Chemistry University of Liverpool Liverpool L7 3NY UK
dc.contributor.institutionSchool of Chemistry The University of Manchester Manchester M13 9PL UK
dc.contributor.institutionInstitut des Matériaux Poreux de Paris Ecole Normale Supérieure ESPCI Paris CNRS PSL University Paris 75005 France
dc.contributor.institutionChemical Sciences Division National Institute of Standards and Technology Gaithersburg MD 20899-8320 USA
dc.contributor.institutionDepartment of Chemical & Biological Engineering Northwestern University 2145 Sheridan Road Evanston IL 60208 USA
dc.contributor.institutionDepartment of Chemistry Northwestern University 2145 Sheridan Road Evanston IL 60208 USA
dc.contributor.institutionMacDiarmid Institute for Advanced Materials and Nanotechnology Institute of Fundamental Sciences Massey University Palmerston North 4442 New Zealand
dc.contributor.institutionDepartment of Mechanical Engineering University of Bristol Bristol BS8 1TR UK
dc.contributor.institutionDepartment of Advanced Materials Science Graduate School of Frontier Sciences The University of Tokyo 5-1-5 Kashiwanoha, Kashiwa Chiba 277-8561 Japan
dc.contributor.institutionDepartment of Chemical Engineering Delft University of Technology van der Maasweg 9 Delft 2629HZ The Netherlands
dc.contributor.institutionCenter for Molecular Modeling (CMM) Ghent University Technologiepark 46 Zwijnaarde B-9052 Belgium
dc.contributor.institutionBCMaterials Basque Center for Materials Applications and Nanostructures UPV/EHU Science Park Leioa 48940 Spain
dc.contributor.institutionIKERBASQUE Basque Foundation for Science Bilbao 48009 Spain
dc.contributor.institutionDepartment of Chemistry University of California – Berkeley Kavli Energy Nanoscience Institute at UC Berkeley Berkeley CA 94720 USA
dc.contributor.institutionBerkeley Global Science Institute Berkeley CA 94720 USA
dc.contributor.institutionDepartment of Chemical and Biomolecular Engineering Korea Advanced Institute of Science and Technology (KAIST) Yuseong-gu Daejeon 34141 South Korea
dc.contributor.institutionDepartamento de Química Inorgánica Universidad Autónoma de Madrid Madrid 28049 Spain
dc.contributor.institutionDepartment of Chemistry Texas A&M University College Station TX 77843 USA
dc.identifier.pages2201502
kaust.personGascon, Jorge
kaust.personTelalovic, Selvedin
refterms.dateFOA2022-05-24T05:57:19Z


Files in this item

Thumbnail
Name:
Advanced Materials - 2022 - Osterrieth - How Reproducible are Surface Areas Calculated from the BET Equation.pdf
Size:
1.894Mb
Format:
PDF
Description:
Published Version
Thumbnail
Name:
adma202201502-sup-0001-suppmat.pdf
Size:
16.64Mb
Format:
PDF
Description:
Supplementary material

This item appears in the following Collection(s)

Show simple item record

Archived with thanks to Advanced Materials under a Creative Commons license, details at: http://creativecommons.org/licenses/by/4.0/
Except where otherwise noted, this item's license is described as Archived with thanks to Advanced Materials under a Creative Commons license, details at: http://creativecommons.org/licenses/by/4.0/