Simon D Hallaert

Simon D Hallaert

Utkal University - Odisha / India
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1401541
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person_outline Simon D Hallaert's MOST POPULAR ARTICLES
1-) The active site of low-temperature methane hydroxylation in iron-containing zeolitesBER Snyder, P Vanelderen, ML Bols, SD Hallaert, LH Böttger, L Ungur, ...Nature 536 (7616), 317-321, 20162932016
2-) Spectroscopic identification of the α-Fe/α-O active site in Fe-CHA zeolite for the low-temperature activation of the methane C–H bondML Bols, SD Hallaert, BER Snyder, J Devos, D Plessers, HM Rhoda, ...Journal of the American Chemical Society 140 (38), 12021-12032, 2018702018
3-) Particle on a Boron Disk: Ring Currents and Disk Aromaticity in B202–TB Tai, RWA Havenith, JL Teunissen, AR Dok, SD Hallaert, MT Nguyen, ...Inorganic Chemistry 52 (18), 10595-10600, 2013472013
4-) H 2 binding to the active site of [NiFe] hydrogenase studied by multiconfigurational and coupled-cluster methodsG Dong, QM Phung, SD Hallaert, K Pierloot, U RydePhysical Chemistry Chemical Physics 19 (16), 10590-10601, 2017492017
5-) Identification of α-Fe in high-silica zeolites on the basis of ab initio electronic structure calculationsSD Hallaert, ML Bols, P Vanelderen, RA Schoonheydt, BF Sels, K PierlootInorganic chemistry 56 (17), 10681-10690, 2017352017