| G3-RAD and G3X-RAD: Modified Gaussian-3 (G3) and Gaussian-3X (G3X) procedures for radical thermochemistry DJ Henry, MB Sullivan, L Radom The Journal of chemical physics 118 (11), 4849-4860, 2003 | 296 | 2003 |
| Natural tri-to hexapeptides self-assemble in water to amyloid β-type fiber aggregates by unexpected α-helical intermediate structures CAE Hauser, R Deng, A Mishra, Y Loo, U Khoe, F Zhuang, DW Cheong, ... Proceedings of the National Academy of Sciences 108 (4), 1361, 2011 | 293 | 2011 |
| Magnetic molybdenum disulfide nanosheet films J Zhang, JM Soon, KP Loh, J Yin, J Ding, MB Sullivian, P Wu Nano letters 7 (8), 2370-2376, 2007 | 274 | 2007 |
| One-dimensional iron− cyclopentadienyl sandwich molecular wire with half metallic, negative differential resistance and high-spin filter efficiency properties L Zhou, SW Yang, MF Ng, MB Sullivan, Tan, L Shen Journal of the American Chemical Society 130 (12), 4023-4027, 2008 | 203 | 2008 |
| First-principles investigations of the atomic, electronic, and thermoelectric properties of equilibrium and strained BiSe and BiTe including van der Waals … X Luo, MB Sullivan, SY Quek Physical Review B 86 (18), 184111, 2012 | 181 | 2012 |
| High-throughput survey of ordering configurations in MXene alloys across compositions and temperatures TL Tan, HM Jin, MB Sullivan, B Anasori, Y Gogotsi ACS nano 11 (5), 4407-4418, 2017 | 161 | 2017 |
| ThioamideDirected Cobalt (III)Catalyzed Selective Amidation of C (sp3)− H Bonds PW Tan, AM Mak, MB Sullivan, DJ Dixon, J Seayad Angewandte Chemie International Edition 56 (52), 16550-16554, 2017 | 146 | 2017 |
| Heterogeneous photo-Fenton reaction on hematite (α-Fe 2 O 3){104},{113} and {001} surface facets JYT Chan, SY Ang, EY Ye, M Sullivan, J Zhang, M Lin Physical Chemistry Chemical Physics 17 (38), 25333-25341, 2015 | 133 | 2015 |
| Study of Pd–Au bimetallic catalysts for CO oxidation reaction by DFT calculations J Zhang, H Jin, MB Sullivan, FCH Lim, P Wu Physical Chemistry Chemical Physics 11 (9), 1441-1446, 2009 | 133 | 2009 |
| Building better lithium-sulfur batteries: from LiNO3 to solid oxide catalyst N Ding, L Zhou, C Zhou, D Geng, J Yang, SW Chien, Z Liu, MF Ng, A Yu, ... Scientific reports 6 (1), 33154, 2016 | 106 | 2016 |
| Step flow versus mosaic film growth in hexagonal boron nitride J Lu, PSE Yeo, Y Zheng, H Xu, CK Gan, MB Sullivan, AH Castro Neto, ... Journal of the American Chemical Society 135 (6), 2368-2373, 2013 | 101 | 2013 |
| meta and para substitution effects on the electronic state energies and ringexpansion reactivities of phenylnitrenes WTG Johnson, MB Sullivan, CJ Cramer International Journal of Quantum Chemistry 85 (45), 492-508, 2001 | 100 | 2001 |
| Transparent conducting properties of SrSnO3 and ZnSnO3 KP Ong, X Fan, A Subedi, MB Sullivan, DJ Singh APL Materials 3 (6), 2015 | 88 | 2015 |
| Structures of Reactive Nitrenium Ions: Time-Resolved Infrared Laser Flash Photolysis and Computational Studies of Substituted N-Methyl-N-arylnitrenium Ions S Srivastava, PH Ruane, JP Toscano, MB Sullivan, CJ Cramer, ... Journal of the American Chemical Society 122 (34), 8271-8278, 2000 | 88 | 2000 |
| Heats of formation of alkali metal and alkaline earth metal oxides and hydroxides: Surprisingly demanding targets for high-level ab initio procedures MB Sullivan, MA Iron, PC Redfern, JML Martin, LA Curtiss, L Radom The Journal of Physical Chemistry A 107 (29), 5617-5630, 2003 | 83 | 2003 |
| Hydrogen adsorption on Rh, Ni, and Pd functionalized single-walled boron nitride nanotubes LP Zhang, P Wu, MB Sullivan The Journal of Physical Chemistry C 115 (10), 4289-4296, 2011 | 81 | 2011 |
| Unravelling V6O13 Diffusion Pathways via CO2 Modification for High-Performance Zinc Ion Battery Cathode W Shi, B Yin, Y Yang, MB Sullivan, J Wang, YW Zhang, ZG Yu, WSV Lee, ... ACS nano 15 (1), 1273-1281, 2021 | 69 | 2021 |
| Adsorption of molecular oxygen on the walls of pristine and carbon-doped (5, 5) boron nitride nanotubes: Spin-polarized density functional study J Zhang, KP Loh, J Zheng, MB Sullivan, P Wu Physical Review B 75 (24), 245301, 2007 | 67 | 2007 |
| Quantum chemical analysis of para-substitution effects on the electronic structure of phenylnitrenium ions in the gas phase and aqueous solution MB Sullivan, K Brown, CJ Cramer, DG Truhlar Journal of the American Chemical Society 120 (45), 11778-11783, 1998 | 64 | 1998 |
| Time-dependent density functional theory (TDDFT) modelling of Pechmann dyes: from accurate absorption maximum prediction to virtual dye screening EAB Kantchev, TB Norsten, MB Sullivan Organic & Biomolecular Chemistry 10 (33), 6682-6692, 2012 | 60 | 2012 |
Kian Ping LohProfessor of Chemistry, National University of Singapore在 nus.edu.sg 的电子邮件经过验证
