A density functional theory study of arsenic immobilization by the Al(III)-modified zeolite clinoptilolite Awuah, Joel, Dzade, NY, Tia, R, Adei, E, Kwakye-Awuah, B, Catlow, CRA and de Leeuw, NH 2016, A density functional theory study of arsenic immobilization by the Al(III)-modified zeolite clinoptilolite, Physical Chemistry Chemical Physics, vol. 18, no. 16, pp. 11297-11305, doi: 10.1039/c6cp00190d. Attached Files Name Description MIMEType Size Downloads Title A density functional theory study of arsenic immobilization by the Al(III)-modified zeolite clinoptilolite Author(s) Awuah, Joel Dzade, NY Tia, R Adei, E Kwakye-Awuah, B Catlow, CRA de Leeuw, NH Journal name Physical Chemistry Chemical Physics Volume number 18 Issue number 16 Start page 11297 End page 11305 Total pages 9 Publisher Royal Society of Chemistry Place of publication Cambridge, Eng. Publication date 2016 ISSN 1463-9076 1463-9084 Keyword(s) ADSORBENTS ADSORPTION Chemistry Chemistry, Physical IRON-OXIDES MECHANISMS MOLECULAR-DYNAMICS NATURAL-WATERS Physical Sciences Physics Physics, Atomic, Molecular & Chemical RELEASE REMOVAL Science & Technology SELENIUM(IV) SORPTION Summary We present density functional theory calculations of the adsorption of arsenic acid (AsO(OH)3) and arsenous acid (As(OH)3) on the Al(iii)-modified natural zeolite clinoptilolite under anhydrous and hydrated conditions. Language eng DOI 10.1039/c6cp00190d Field of Research 02 Physical Sciences 03 Chemical Sciences 09 Engineering HERDC Research category C1.1 Refereed article in a scholarly journal Persistent URL http://hdl.handle.net/10536/DRO/DU:30152926 Document type: Journal Article Collections: Institute for Frontier Materials GTP Research Related Links Link Description Connect to published version Go to link with your DU access privileges   Connect to Elements publication management system Go to link with your DU access privileges     Unless expressly stated otherwise, the copyright for items in DRO is owned by the author, with all rights reserved. Versions Version Filter Type Mon, 28 Jun 2021, 08:13:39 EST Tue, 29 Jun 2021, 05:01:27 EST Tue, 29 Jun 2021, 06:05:25 EST Tue, 29 Jun 2021, 08:47:27 EST Tue, 19 Jul 2022, 15:48:05 EST Thu, 21 Jul 2022, 12:55:53 EST Wed, 27 Jul 2022, 08:15:16 EST Wed, 27 Jul 2022, 08:44:14 EST Wed, 27 Jul 2022, 13:17:03 EST Wed, 27 Jul 2022, 13:17:46 EST Filtered Full Citation counts:   Cited 10 times in TR Web of Science Cited 0 times in Scopus Search Google Scholar Access Statistics: 9 Abstract Views, 0 File Downloads  -  Detailed Statistics Created: Mon, 28 Jun 2021, 08:13:39 EST