Journal Articles
Permanent URI for this collectionhttps://mro.massey.ac.nz/handle/10179/7915
Browse
3 results
Search Results
Item Robust Co(II)-Based Metal-Organic Framework for the Efficient Uptake and Selective Detection of SO2(ACS Publications (American Chemical Society), 2024-03-26) López-Cervantes VB; López-Olvera A; Obeso JL; Torres IK; Martínez-Ahumada E; Carmona-Monroy P; Sánchez-González E; Solís-Ibarra D; Lima E; Jangodaz E; Babarao R; Ibarra LA; Telfer SGMUF-16 is a porous metal-organic framework comprising cobalt(II) ions and 5-aminoisophthalate ligands. Here, we measured its reversible SO2 adsorption-desorption isotherm around room temperature and up to 1 bar and observed a high capacity for SO2 (2.2 mmol g-1 at 298 K and 1 bar). The uptake of SO2 was characterized by Fourier transform infrared (FT-IR) spectroscopy, which indicated hydrogen bonding between the SO2 guest molecules and amino functional groups of the framework. The location and packing of the SO2 molecules were confirmed by computational studies, namely, density functional theory (DFT) calculations of the strongest adsorption site and grand canonical Monte Carlo (GCMC) simulations of the adsorption isotherm. Furthermore, MUF-16 showed a remarkable selective fluorescence response to SO2 compared to other gases (CO2, NO2, N2, O2, CH4, and water vapor). The possible fluorescence mechanism was determined by using time-resolved photoluminescence. Also, the limit of detection (LOD) was calculated to be 1.26 mM (∼80.72 ppm) in a tetrahydrofuran (THF) solution of SO2Item How Reproducible are Surface Areas Calculated from the BET Equation?(Wiley-VCH GmbH, 2022-05-23) 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; Bu X-H; Chang Z; Bunzen H; Champness NR; Griffin SL; Chen B; Lin R-B; Coasne B; Cohen S; Moreton JC; Colón YJ; Chen L; Clowes R; Coudert F-X; Cui Y; Hou B; D'Alessandro DM; Doheny PW; Dincă M; Sun C; Doonan C; Huxley MT; Evans JD; Falcaro P; Ricco R; Farha O; Idrees KB; Islamoglu T; Feng P; Yang H; Forgan RS; Bara D; Furukawa S; Sanchez E; Gascon J; Telalović S; Ghosh SK; Mukherjee S; Hill MR; Sadiq MM; Horcajada P; Salcedo-Abraira P; Kaneko K; Kukobat R; Kenvin J; Keskin S; Kitagawa S; Otake K-I; Lively RP; DeWitt SJA; Llewellyn P; Lotsch BV; Emmerling ST; Pütz AM; Martí-Gastaldo C; Padial NM; García-Martínez J; Linares N; Maspoch D; Suárez Del Pino JA; Moghadam P; Oktavian R; Morris RE; Wheatley PS; Navarro J; Petit C; Danaci D; Rosseinsky MJ; Katsoulidis AP; Schröder M; Han X; Yang S; Serre C; Mouchaham G; Sholl DS; Thyagarajan R; Siderius D; Snurr RQ; Goncalves RB; Telfer S; Lee SJ; Ting VP; Rowlandson JL; Uemura T; Iiyuka T; van der Veen MA; Rega D; Van Speybroeck V; Rogge SMJ; Lamaire A; Walton KS; Bingel LW; Wuttke S; Andreo J; Yaghi O; Zhang B; Yavuz CT; Nguyen TS; Zamora F; Montoro C; Zhou H; Kirchon A; Fairen-Jimenez DPorosity 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.Item Comparison of Cd(II) adsorption properties onto cellulose, hemicellulose and lignin extracted from rice bran(Elsevier Ltd, 2021-06) Wu C; Ren M; Zhang X; Li C; Li T; Yang Z; Chen Z; Wang LRice bran, an underutilized by-product obtained from outer rice layers, has received wide interest due to its abundance, eco-friendliness, and low cost. In this research, cellulose, hemicellulose and lignin as the main components of rice bran were fractionated, and their Cd(II) adsorption capacity, behavior and mechanism were further studied. The adsorption capacity of cellulose for Cd(II) was 5.79 mg/g within the equilibrium time of 10 min, which was 1.8 and 3.6 times those of hemicellulose and lignin, respectively. The Cd(II) adsorption onto cellulose exhibited monolayer surface behavior, whilst the heterogeneous adsorption behavior was observed for hemicellulose and lignin. These differences were related to the discrepancy of morphology and chemical composition in three polymers. The multi-hole sticks morphology of cellulose and porous blocky structure of hemicellulose were observed, while lignin showed compact and agglomerated blocky structure. Cellulose had numerous available adsorption sites including the oxygen-containing functional groups, which bonded with Cd(II) driven by chemical interaction. In conclusion, it highlights that cellulose from rice bran has the great potential of being applied as adsorbent for the Cd(II) removal.
