{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,2]],"date-time":"2026-10-02T02:28:28Z","timestamp":1790908108172,"version":"4.1.0"},"reference-count":82,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2023,2,1]],"date-time":"2023-02-01T00:00:00Z","timestamp":1675209600000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["32061123007"],"award-info":[{"award-number":["32061123007"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["41877030"],"award-info":[{"award-number":["41877030"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100012226","name":"Fundamental Research Funds for the Central Universities","doi-asserted-by":"publisher","award":["2662022ZHQD003"],"award-info":[{"award-number":["2662022ZHQD003"]}],"id":[{"id":"10.13039\/501100012226","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Water Research"],"published-print":{"date-parts":[[2023,2]]},"DOI":"10.1016\/j.watres.2022.119534","type":"journal-article","created":{"date-parts":[[2022,12,28]],"date-time":"2022-12-28T10:31:42Z","timestamp":1672223502000},"page":"119534","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":22,"special_numbering":"C","title":["Generic CD-MUSIC-eSGC model parameters to predict the surface reactivity of iron (hydr)oxides"],"prefix":"10.1016","volume":"230","author":[{"given":"Jiezi","family":"Jin","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yu","family":"Liang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mingxia","family":"Wang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Linchuan","family":"Fang","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Juan","family":"Xiong","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jingtao","family":"Hou","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Wenfeng","family":"Tan","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1904-1182","authenticated-orcid":false,"given":"Luuk","family":"Koopal","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.watres.2022.119534_bib0001","doi-asserted-by":"crossref","first-page":"1355","DOI":"10.1021\/acsearthspacechem.0c00356","article-title":"Surface complexation modeling approach for aluminum-substituted ferrihydrites","volume":"5","author":"Adams","year":"2021","journal-title":"ACS Earth Space Chem."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0002","doi-asserted-by":"crossref","first-page":"476","DOI":"10.1016\/j.jcis.2004.12.032","article-title":"Effects of pH and ionic strength on the adsorption of phosphate and arsenate at the goethite-water interface","volume":"285","author":"Antelo","year":"2005","journal-title":"J. Colloid Interface Sci."},{"issue":"20","key":"10.1016\/j.watres.2022.119534_bib0003","doi-asserted-by":"crossref","first-page":"10927","DOI":"10.1021\/jp5023554","article-title":"Surface charge of a nanoparticle interacting with a flat substrate","volume":"118","author":"Atalay","year":"2014","journal-title":"J. Phys. Chem. C"},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0004","doi-asserted-by":"crossref","first-page":"366","DOI":"10.1021\/acsestwater.0c00142","article-title":"Predicting the breakthrough of ternary Ca-Uranyl-Carbonate species in mineral water treated by a fixed-bed granular ferric hydroxide adsorbent","volume":"1","author":"Bahr","year":"2020","journal-title":"ACS ES&T Water"},{"issue":"7","key":"10.1016\/j.watres.2022.119534_bib0006","doi-asserted-by":"crossref","first-page":"4714","DOI":"10.1021\/jp2110456","article-title":"Water structure and hydrogen bonding at goethite\/water interfaces: implications for proton affinities","volume":"116","author":"Boily","year":"2012","journal-title":"J. Phys. Chem. Lett."},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0005","doi-asserted-by":"crossref","first-page":"11","DOI":"10.1016\/S0927-7757(00)00712-3","article-title":"Modeling proton binding at the goethite (\u03b1-FeOOH)-water interface","volume":"179","author":"Boily","year":"2001","journal-title":"Colloids Surfaces A"},{"key":"10.1016\/j.watres.2022.119534_bib0007","doi-asserted-by":"crossref","first-page":"34","DOI":"10.1016\/j.chemgeo.2016.12.018","article-title":"Surface structure of ferrihydrite: insights from modeling surface charge","volume":"464","author":"Bompoti","year":"2017","journal-title":"Chem. Geol."},{"issue":"4","key":"10.1016\/j.watres.2022.119534_bib0008","doi-asserted-by":"crossref","first-page":"473","DOI":"10.1021\/acsearthspacechem.8b00125","article-title":"Assessment of modeling uncertainties using a multistart optimization tool for surface complexation equilibrium parameters (MUSE)","volume":"3","author":"Bompoti","year":"2018","journal-title":"ACS Earth Space Chem."},{"issue":"11","key":"10.1016\/j.watres.2022.119534_bib0009","doi-asserted-by":"crossref","first-page":"6352","DOI":"10.1021\/acs.est.9b01183","article-title":"A unified surface complexation modeling approach for chromate adsorption on iron oxides","volume":"53","author":"Bompoti","year":"2019","journal-title":"Environ. Sci. Technol."},{"issue":"5540","key":"10.1016\/j.watres.2022.119534_bib0010","doi-asserted-by":"crossref","first-page":"67","DOI":"10.1126\/science.1063544","article-title":"How minerals react with water","volume":"294","author":"Brown","year":"2001","journal-title":"Science"},{"issue":"3","key":"10.1016\/j.watres.2022.119534_bib0011","doi-asserted-by":"crossref","first-page":"359","DOI":"10.1039\/CS9780700359","article-title":"Bond valences\u2014a simple structural model for inorganic chemistry","volume":"7","author":"Brown","year":"1978","journal-title":"Chem. Soc. Rev."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0012","doi-asserted-by":"crossref","first-page":"309","DOI":"10.1021\/ja01269a023","article-title":"Adsorption of gases in multimolecular layers","volume":"60","author":"Brunauer","year":"1938","journal-title":"J. Am. Chem. Soc."},{"issue":"22","key":"10.1016\/j.watres.2022.119534_bib0013","doi-asserted-by":"crossref","first-page":"5313","DOI":"10.1016\/j.gca.2007.09.019","article-title":"Interfacial water structure on the (012) surface of hematite: ordering and reactivity in comparison with corundum","volume":"71","author":"Catalano","year":"2007","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"7","key":"10.1016\/j.watres.2022.119534_bib0014","doi-asserted-by":"crossref","first-page":"4016","DOI":"10.1021\/acs.est.9b06288","article-title":"Molecular mechanisms of lead binding to ferrihydrite-bacteria composites: ITC, XAFS, and \u03bc-XRF investigations","volume":"54","author":"Chen","year":"2020","journal-title":"Environ. Sci. Technol."},{"issue":"19-20","key":"10.1016\/j.watres.2022.119534_bib0015","doi-asserted-by":"crossref","first-page":"2929","DOI":"10.1016\/S0016-7037(99)00266-5","article-title":"Competitive sorption of copper and lead at the oxide-water interface: implications for surface site density","volume":"63","author":"Christl","year":"1999","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"3","key":"10.1016\/j.watres.2022.119534_bib0016","doi-asserted-by":"crossref","first-page":"480","DOI":"10.1016\/S0021-9797(78)80009-5","article-title":"Surface ionization and complexation at the oxide\/water interface: I. Computation of electrical double layer properties in simple electrolytes","volume":"63","author":"Davis","year":"1978","journal-title":"J. Colloid Interface Sci."},{"key":"10.1016\/j.watres.2022.119534_bib0017","doi-asserted-by":"crossref","first-page":"92","DOI":"10.1016\/j.apgeochem.2013.06.013","article-title":"Surface complexation modeling for sulfate adsorption on ferrihydrite consistent with in situ infrared spectroscopic observations","volume":"36","author":"Fukushi","year":"2013","journal-title":"Appl. Geochem."},{"key":"10.1016\/j.watres.2022.119534_bib0018","doi-asserted-by":"crossref","first-page":"248","DOI":"10.1016\/j.gca.2018.09.008","article-title":"Capturing the variable reactivity of goethites in surface complexation modeling by correlating model parameters with specific surface area","volume":"244","author":"Han","year":"2019","journal-title":"Geochim. Cosmochim. Acta"},{"key":"10.1016\/j.watres.2022.119534_bib0019","doi-asserted-by":"crossref","first-page":"316","DOI":"10.1016\/j.gca.2012.12.002","article-title":"Surface and mineral structure of ferrihydrite","volume":"105","author":"Hiemstra","year":"2013","journal-title":"Geochim. Cosmochim. Acta"},{"key":"10.1016\/j.watres.2022.119534_bib0020","doi-asserted-by":"crossref","first-page":"453","DOI":"10.1016\/j.gca.2018.07.017","article-title":"Ferrihydrite interaction with silicate and competing oxyanions: geometry and hydrogen bonding of surface species","volume":"238","author":"Hiemstra","year":"2018","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0021","doi-asserted-by":"crossref","first-page":"41","DOI":"10.1016\/j.gca.2009.10.018","article-title":"Nanoparticles in natural systems I: the effective reactive surface area of the natural oxide fraction in field samples","volume":"74","author":"Hiemstra","year":"2010","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0022","doi-asserted-by":"crossref","first-page":"8","DOI":"10.1016\/j.jcis.2007.01.065","article-title":"Interaction of silicic acid with goethite","volume":"310","author":"Hiemstra","year":"2007","journal-title":"J. Colloid Interface Sci."},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0023","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.jcis.2006.05.008","article-title":"On the relationship between charge distribution, surface hydration, and the structure of the interface of metal hydroxides","volume":"301","author":"Hiemstra","year":"2006","journal-title":"J. Colloid Interface Sci."},{"issue":"15","key":"10.1016\/j.watres.2022.119534_bib0024","doi-asserted-by":"crossref","first-page":"4423","DOI":"10.1016\/j.gca.2009.04.032","article-title":"A surface structural model for ferrihydrite I: sites related to primary charge, molar mass, and mass density","volume":"73","author":"Hiemstra","year":"2009","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0025","doi-asserted-by":"crossref","first-page":"488","DOI":"10.1006\/jcis.1996.0242","article-title":"A surface structural approach to ion adsorption: the charge distribution (CD) model","volume":"179","author":"Hiemstra","year":"1996","journal-title":"J. Colloid Interface Sci."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0026","doi-asserted-by":"crossref","first-page":"680","DOI":"10.1006\/jcis.1996.0666","article-title":"Intrinsic proton affinity of reactive surface groups of metal (hydr) oxides: the bond valence principle","volume":"184","author":"Hiemstra","year":"1996","journal-title":"J. Colloid Interface Sci."},{"issue":"6","key":"10.1016\/j.watres.2022.119534_bib0027","doi-asserted-by":"crossref","first-page":"1265","DOI":"10.1039\/C6EN00061D","article-title":"Reactivity of ferrihydrite and ferritin in relation to surface structure, size, and nanoparticle formation studied for phosphate and arsenate","volume":"3","author":"Hiemstra","year":"2016","journal-title":"Environ. Sci. Nano"},{"issue":"5870","key":"10.1016\/j.watres.2022.119534_bib0028","doi-asserted-by":"crossref","first-page":"1631","DOI":"10.1126\/science.1141134","article-title":"Nanominerals, mineral nanoparticles, and Earth systems","volume":"319","author":"Hochella","year":"2008","journal-title":"Science"},{"issue":"8","key":"10.1016\/j.watres.2022.119534_bib0029","doi-asserted-by":"crossref","first-page":"1790","DOI":"10.1039\/C8EN00548F","article-title":"Facet-dependent contaminant removal properties of hematite nanocrystals and their environmental implications","volume":"5","author":"Huang","year":"2018","journal-title":"Environ. Sci. Nano"},{"key":"10.1016\/j.watres.2022.119534_bib0030","doi-asserted-by":"crossref","first-page":"127","DOI":"10.1016\/j.apcatb.2015.06.061","article-title":"Hematite facet confined ferrous ions as high efficient Fenton catalysts to degrade organic contaminants by lowering H2O2 decomposition energetic span","volume":"181","author":"Huang","year":"2016","journal-title":"Appl. Catal. B"},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0031","doi-asserted-by":"crossref","first-page":"206","DOI":"10.1016\/j.jcis.2007.11.032","article-title":"The dependence of hematite site-occupancy standard state triple-layer model parameters on inner-layer capacitance","volume":"319","author":"Hwang","year":"2008","journal-title":"J. Colloid Interface Sci."},{"key":"10.1016\/j.watres.2022.119534_bib0032","series-title":"ECOSAT, Equilibrium Calculation of Speciation and Transport, Technical Report","author":"Keizer","year":"1998"},{"key":"10.1016\/j.watres.2022.119534_bib0033","series-title":"FIT, Technical Report WD\/93\/23","author":"Kinniburgh","year":"1993"},{"key":"10.1016\/j.watres.2022.119534_bib0034","doi-asserted-by":"crossref","DOI":"10.1016\/j.cis.2020.102138","article-title":"Equilibrium mono-and multicomponent adsorption models: from homogeneous ideal to heterogeneous non-ideal binding","volume":"280","author":"Koopal","year":"2020","journal-title":"Adv. Colloid Interface Sci."},{"issue":"16","key":"10.1016\/j.watres.2022.119534_bib0035","doi-asserted-by":"crossref","first-page":"6221","DOI":"10.1021\/es1015313","article-title":"Convergence-optimized procedure for applying the NICA-Donnan model to potentiometric titrations of humic substances","volume":"44","author":"Lenoir","year":"2010","journal-title":"Environ. Sci. Technol."},{"key":"10.1016\/j.watres.2022.119534_bib0036","series-title":"Ph.D. Dissertation","author":"Liang","year":"1988"},{"key":"10.1016\/j.watres.2022.119534_bib0037","doi-asserted-by":"crossref","DOI":"10.1016\/j.chemosphere.2021.130597","article-title":"Insights into the improving mechanism of defect-mediated As(V) adsorption on hematite nanoplates","volume":"280","author":"Liang","year":"2021","journal-title":"Chemosphere"},{"key":"10.1016\/j.watres.2022.119534_bib0038","doi-asserted-by":"crossref","first-page":"110383","DOI":"10.1016\/j.envres.2020.110383","article-title":"Facet-dependent surface charge and Pb2+ adsorption characteristics of hematite nanoparticles: CD-MUSIC-eSGC modeling","volume":"196","author":"Liang","year":"2021","journal-title":"Environ. Res."},{"key":"10.1016\/j.watres.2022.119534_bib0039","doi-asserted-by":"crossref","DOI":"10.1016\/j.scitotenv.2021.148202","article-title":"Microstructure of Al-substituted goethite and its adsorption performance for Pb(II) and As(V)","volume":"790","author":"Liang","year":"2021","journal-title":"Sci. Total Environ."},{"key":"10.1016\/j.watres.2022.119534_bib0040","doi-asserted-by":"crossref","DOI":"10.1016\/j.geoderma.2020.114799","article-title":"Adsorption of phosphate and cadmium on iron (oxyhydr)oxides: a comparative study on ferrihydrite, goethite, and hematite","volume":"383","author":"Liu","year":"2021","journal-title":"Geoderma"},{"issue":"36","key":"10.1016\/j.watres.2022.119534_bib0041","doi-asserted-by":"crossref","first-page":"8924","DOI":"10.1021\/acs.langmuir.7b01814","article-title":"Crystal face distributions and surface site densities of two synthetic goethites: implications for adsorption capacities as a function of particle size","volume":"33","author":"Livi","year":"2017","journal-title":"Langmuir"},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0042","doi-asserted-by":"crossref","first-page":"155","DOI":"10.1016\/j.jcis.2007.08.055","article-title":"Protonation of different goethite surfaces\u2014unified models for NaNO3 and NaCl media","volume":"317","author":"L\u00fctzenkirchen","year":"2008","journal-title":"J. Colloid Interface Sci."},{"issue":"20","key":"10.1016\/j.watres.2022.119534_bib0043","first-page":"11660","article-title":"Facet-mediated adsorption and molecular fractionation of humic substances on hematite surfaces","volume":"52","author":"Lv","year":"2018","journal-title":"Environ. Sci. Technol."},{"key":"10.1016\/j.watres.2022.119534_bib0044","doi-asserted-by":"crossref","first-page":"147","DOI":"10.1016\/j.jcis.2013.10.066","article-title":"Surface complexation modeling of Hg(II) adsorption at the goethite\/water interface using the charge distribution multi-site complexation (CD-MUSIC) model","volume":"418","author":"Mangold","year":"2014","journal-title":"J. Colloid Interface Sci."},{"key":"10.1016\/j.watres.2022.119534_bib0045","doi-asserted-by":"crossref","first-page":"289","DOI":"10.1016\/j.gca.2020.07.032","article-title":"High and low affinity sites of ferrihydrite for metal ion adsorption: data and modeling of the alkaline-earth ions Be, Mg, Ca, Sr, Ba, and Ra","volume":"286","author":"Mendez","year":"2020","journal-title":"Geochim. Cosmochim. Acta"},{"key":"10.1016\/j.watres.2022.119534_bib0046","doi-asserted-by":"crossref","DOI":"10.1016\/j.chemgeo.2019.119304","article-title":"Surface area of ferrihydrite consistently related to primary surface charge, ion pair formation, and specific ion adsorption","volume":"532","author":"Mendez","year":"2020","journal-title":"Chem. Geol."},{"issue":"4","key":"10.1016\/j.watres.2022.119534_bib0047","doi-asserted-by":"crossref","first-page":"545","DOI":"10.1021\/acsearthspacechem.9b00320","article-title":"Ternary complex formation of phosphate with Ca and Mg ions binding to ferrihydrite: experiments and mechanisms","volume":"4","author":"Mendez","year":"2020","journal-title":"ACS Earth Space Chem."},{"issue":"19","key":"10.1016\/j.watres.2022.119534_bib0048","doi-asserted-by":"crossref","first-page":"11990","DOI":"10.1021\/acs.est.0c02163","article-title":"Assessing the reactive surface area of soils and the association of soil organic carbon with natural oxide nanoparticles using ferrihydrite as proxy","volume":"54","author":"Mendez","year":"2020","journal-title":"Environ. Sci. Technol."},{"key":"10.1016\/j.watres.2022.119534_bib0049","doi-asserted-by":"crossref","DOI":"10.1016\/j.geoderma.2021.115517","article-title":"Surface reactivity of the natural metal (hydr) oxides in weathered tropical soils","volume":"406","author":"Mendez","year":"2022","journal-title":"Geoderma"},{"key":"10.1016\/j.watres.2022.119534_bib0050","doi-asserted-by":"crossref","first-page":"189","DOI":"10.1016\/j.chemgeo.2018.05.036","article-title":"Revisiting models of Cd, Cu, Pb and Zn adsorption onto Fe(III) oxides","volume":"493","author":"Michael","year":"2018","journal-title":"Chem. Geol."},{"issue":"7","key":"10.1016\/j.watres.2022.119534_bib0051","doi-asserted-by":"crossref","first-page":"2787","DOI":"10.1073\/pnas.0910170107","article-title":"Ordered ferrimagnetic form of ferrihydrite reveals links among structure, composition, and magnetism","volume":"107","author":"Michel","year":"2010","journal-title":"Proc. Natl. Acad. Sci., U. S. A."},{"issue":"5832","key":"10.1016\/j.watres.2022.119534_bib0052","doi-asserted-by":"crossref","first-page":"1726","DOI":"10.1126\/science.1142525","article-title":"The structure of ferrihydrite, a nanocrystalline material","volume":"316","author":"Michel","year":"2007","journal-title":"Science"},{"issue":"5870","key":"10.1016\/j.watres.2022.119534_bib0053","doi-asserted-by":"crossref","first-page":"1635","DOI":"10.1126\/science.1148614","article-title":"Size-driven structural and thermodynamic complexity in iron oxides","volume":"319","author":"Navrotsky","year":"2008","journal-title":"Science"},{"issue":"40","key":"10.1016\/j.watres.2022.119534_bib0054","doi-asserted-by":"crossref","first-page":"11918","DOI":"10.1021\/acs.langmuir.0c02000","article-title":"Modeling surface charge regulation of colloidal particles in aqueous solutions","volume":"36","author":"Ong","year":"2020","journal-title":"Langmuir"},{"issue":"22","key":"10.1016\/j.watres.2022.119534_bib0055","doi-asserted-by":"crossref","first-page":"21721","DOI":"10.1007\/s11356-018-2328-0","article-title":"Analysis of mercury adsorption at the gibbsite-water interface using the CD-MUSIC model","volume":"25","author":"Park","year":"2018","journal-title":"Environ. Sci. Pollut. Res."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0056","doi-asserted-by":"crossref","first-page":"244","DOI":"10.1016\/S0021-9797(03)00058-4","article-title":"Morphology and surface heterogeneities in synthetic goethites","volume":"261","author":"Pr\u00e9lot","year":"2003","journal-title":"J. Colloid Interface Sci."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0057","doi-asserted-by":"crossref","first-page":"312","DOI":"10.1016\/j.jcis.2005.06.089","article-title":"A new surface structural approach to ion adsorption: tracing the location of electrolyte ions","volume":"293","author":"Rahnemaie","year":"2006","journal-title":"J. Colloid Interface Sci."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0058","doi-asserted-by":"crossref","first-page":"415","DOI":"10.1016\/j.jcis.2007.07.017","article-title":"Carbonate adsorption on goethite in competition with phosphate","volume":"315","author":"Rahnemaie","year":"2007","journal-title":"J. Colloid Interface Sci."},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0059","doi-asserted-by":"crossref","first-page":"199","DOI":"10.1006\/jcis.2000.6982","article-title":"Electrolyte anion affinity and its effect on oxyanion adsorption on goethite","volume":"229","author":"Rietra","year":"2000","journal-title":"J. Colloid Interface Sci."},{"issue":"8","key":"10.1016\/j.watres.2022.119534_bib0060","doi-asserted-by":"crossref","first-page":"2257","DOI":"10.1016\/j.gca.2010.01.025","article-title":"Goethite surface reactivity: III. Unifying arsenate adsorption behavior through a variable crystal face-site density model","volume":"74","author":"Salazar-Camacho","year":"2010","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0061","doi-asserted-by":"crossref","first-page":"241","DOI":"10.1006\/jcis.1997.5207","article-title":"Absolute aggregation rate constants of hematite particles in aqueous suspensions: a comparison of two different surface morphologies","volume":"196","author":"Schudel","year":"1997","journal-title":"J. Colloid Interface Sci."},{"key":"10.1016\/j.watres.2022.119534_bib0062","series-title":"Iron Oxides in the Laboratory: Preparation and Characterization","author":"Schwertmann","year":"2008"},{"issue":"15","key":"10.1016\/j.watres.2022.119534_bib0063","article-title":"Recent progress in understanding the mechanism of heavy metals retention by iron (oxyhydr) oxides","volume":"752","author":"Shi","year":"2021","journal-title":"Sci. Total Environ."},{"issue":"30","key":"10.1016\/j.watres.2022.119534_bib0064","doi-asserted-by":"crossref","first-page":"70","DOI":"10.1016\/j.jhazmat.2015.03.048","article-title":"Formation of iron (hydr)oxides during the abiotic oxidation of Fe(II) in the presence of arsenate","volume":"294","author":"Song","year":"2015","journal-title":"J. Hazard. Mater."},{"key":"10.1016\/j.watres.2022.119534_bib0065","doi-asserted-by":"crossref","first-page":"345","DOI":"10.1016\/j.gca.2016.10.015","article-title":"Accessible reactive surface area and abiotic redox reactivity of iron oxyhydroxides in acidic brines","volume":"197","author":"Strehlau","year":"2017","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0066","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1016\/S0016-7037(02)01074-8","article-title":"Standard states for the activities of mineral surface sites and species","volume":"67","author":"Sverjensky","year":"2003","journal-title":"Geochim. Cosmochim. Acta"},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0067","doi-asserted-by":"crossref","first-page":"225","DOI":"10.1016\/j.gca.2004.05.040","article-title":"Prediction of surface charge on oxides in salt solutions: revisions for 1: 1 (M+ L-) electrolytes","volume":"69","author":"Sverjensky","year":"2005","journal-title":"Geochim. Cosmochim. Acta"},{"key":"10.1016\/j.watres.2022.119534_bib0068","series-title":"The Iron Oxides Strike Back: From Biomedical Applications to Energy Storage Devices and Photoelectrochemical Water Splitting","first-page":"5243","author":"Tartaj","year":"2011"},{"issue":"12","key":"10.1016\/j.watres.2022.119534_bib0069","doi-asserted-by":"crossref","first-page":"3010","DOI":"10.1021\/ja01014a003","article-title":"Determination of specific surface areas of dispersed materials. Comparison of the negative adsorption method with some other methods","volume":"90","author":"Van den Hul","year":"1968","journal-title":"J. Am. Chem. Soc."},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0070","doi-asserted-by":"crossref","first-page":"45","DOI":"10.1006\/jcis.1996.0355","article-title":"Comparison of different site binding models for cation sorption: description of pH dependency, salt dependency, and cation-proton exchange","volume":"181","author":"Venema","year":"1996","journal-title":"J. Colloid Interface Sci."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0071","doi-asserted-by":"crossref","first-page":"282","DOI":"10.1006\/jcis.1997.5245","article-title":"Intrinsic proton affinity of reactive surface groups of metal (hydr)oxides: application to iron (hydr)oxides","volume":"198","author":"Venema","year":"1998","journal-title":"J. Colloid Interface Sci."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0072","first-page":"139","article-title":"A unified surface structural model for ferrihydrite: proton charge, electrolyte binding, and arsenate adsorption","volume":"27","author":"Villalobos","year":"2011","journal-title":"Rev. Int. de Contam. Ambient."},{"issue":"2","key":"10.1016\/j.watres.2022.119534_bib0073","doi-asserted-by":"crossref","first-page":"412","DOI":"10.1016\/j.jcis.2009.04.052","article-title":"Goethite surface reactivity: II. A microscopic site-density model that describes its surface area-normalized variability","volume":"336","author":"Villalobos","year":"2009","journal-title":"J. Colloid Interface Sci."},{"issue":"18","key":"10.1016\/j.watres.2022.119534_bib0074","doi-asserted-by":"crossref","first-page":"10322","DOI":"10.1021\/es401301z","article-title":"Effect of ferrihydrite crystallite size on phosphate adsorption reactivity","volume":"47","author":"Wang","year":"2013","journal-title":"Environ. Sci. Technol."},{"issue":"9","key":"10.1016\/j.watres.2022.119534_bib0075","doi-asserted-by":"crossref","first-page":"3982","DOI":"10.1021\/es305180e","article-title":"Mass action expressions for bidentate adsorption in surface complexation modeling: theory and practice","volume":"47","author":"Wang","year":"2013","journal-title":"Environ. Sci. Technol."},{"issue":"4","key":"10.1016\/j.watres.2022.119534_bib0076","doi-asserted-by":"crossref","first-page":"437","DOI":"10.1346\/CCMN.1996.0440401","article-title":"Vicinal faces on synthetic goethite observed by atomic force microscopy","volume":"44","author":"Weidler","year":"1996","journal-title":"Clays Clay Miner."},{"issue":"3","key":"10.1016\/j.watres.2022.119534_bib0077","doi-asserted-by":"crossref","first-page":"1348","DOI":"10.1021\/acs.est.7b05412","article-title":"Effect of soil fulvic and humic acids on Pb binding to the goethite\/solution interface: ligand charge distribution modeling and speciation distribution of Pb","volume":"52","author":"Xiong","year":"2018","journal-title":"Environ. Sci. Technol."},{"issue":"12","key":"10.1016\/j.watres.2022.119534_bib0078","doi-asserted-by":"crossref","first-page":"3625","DOI":"10.1039\/C9EN00539K","article-title":"Phosphate speciation on Al-substituted goethite: ATR-FTIR\/2D-COS and CD-MUSIC modeling","volume":"6","author":"Xu","year":"2019","journal-title":"Environ. Sci. Nano"},{"issue":"5","key":"10.1016\/j.watres.2022.119534_bib0079","doi-asserted-by":"crossref","first-page":"3138","DOI":"10.1021\/acs.est.1c07801","article-title":"Mechanistic study for antimony adsorption and precipitation on hematite facets","volume":"56","author":"Yan","year":"2022","journal-title":"Environ. Sci. Technol."},{"issue":"23","key":"10.1016\/j.watres.2022.119534_bib0080","doi-asserted-by":"crossref","first-page":"15921","DOI":"10.1021\/acs.est.1c05343","article-title":"Surface acidity and As(V) complexation of iron oxyhydroxides: insights from first-principles molecular dynamics simulations","volume":"55","author":"Zhang","year":"2021","journal-title":"Environ. Sci. Technol."},{"issue":"18","key":"10.1016\/j.watres.2022.119534_bib0081","doi-asserted-by":"crossref","first-page":"10522","DOI":"10.1021\/acs.est.8b02644","article-title":"CD-MUSIC-EDL modeling of Pb2+ adsorption on birnessites: role of vacant and edge sites","volume":"52","author":"Zhao","year":"2018","journal-title":"Environ. Sci. Technol."},{"issue":"1","key":"10.1016\/j.watres.2022.119534_bib0082","doi-asserted-by":"crossref","first-page":"40","DOI":"10.1016\/j.jcis.2006.12.055","article-title":"Proton interaction in phosphate adsorption onto goethite","volume":"308","author":"Zhong","year":"2007","journal-title":"J. Colloid Interface Sci."}],"container-title":["Water Research"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0043135422014798?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0043135422014798?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2024,8,25]],"date-time":"2024-08-25T14:45:06Z","timestamp":1724597106000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0043135422014798"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,2]]},"references-count":82,"alternative-id":["S0043135422014798"],"URL":"https:\/\/doi.org\/10.1016\/j.watres.2022.119534","relation":{},"ISSN":["0043-1354"],"issn-type":[{"value":"0043-1354","type":"print"}],"subject":[],"published":{"date-parts":[[2023,2]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Generic CD-MUSIC-eSGC model parameters to predict the surface reactivity of iron (hydr)oxides","name":"articletitle","label":"Article Title"},{"value":"Water Research","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.watres.2022.119534","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2022 Published by Elsevier Ltd.","name":"copyright","label":"Copyright"}],"article-number":"119534"}}