| Cooperative insertion of CO2 in diamine-appended metal-organic frameworks TM McDonald, JA Mason, X Kong, ED Bloch, D Gygi, A Dani, V Crocella, ... Nature 519 (7543), 303-308, 2015 | 1019 | 2015 |
| Attosecond band-gap dynamics in silicon M Schultze, K Ramasesha, CD Pemmaraju, SA Sato, D Whitmore, ... Science 346 (6215), 1348-1352, 2014 | 539 | 2014 |
| Aqueous vs. nonaqueous Zn-ion batteries: consequences of the desolvation penalty at the interface D Kundu, SH Vajargah, L Wan, B Adams, D Prendergast, LF Nazar Energy & Environmental Science 11 (4), 881-892, 2018 | 520 | 2018 |
| Coupling between oxygen redox and cation migration explains unusual electrochemistry in lithium-rich layered oxides WE Gent, K Lim, Y Liang, Q Li, T Barnes, SJ Ahn, KH Stone, M McIntire, ... Nature communications 8 (1), 2091, 2017 | 490 | 2017 |
| X-ray absorption spectra of water from first principles calculations D Prendergast, G Galli Physical review letters 96 (21), 215502, 2006 | 438 | 2006 |
| Theory-driven design of high-valence metal sites for water oxidation confirmed using in situ soft X-ray absorption X Zheng, B Zhang, P De Luna, Y Liang, R Comin, O Voznyy, L Han, ... Nature chemistry 10 (2), 149-154, 2018 | 427 | 2018 |
| The structure of interfacial water on gold electrodes studied by x-ray absorption spectroscopy JJ Velasco-Velez, CH Wu, TA Pascal, LF Wan, J Guo, D Prendergast, ... Science 346 (6211), 831-834, 2014 | 416 | 2014 |
| Nanostructured metal hydrides for hydrogen storage A Schneemann, JL White, SY Kang, S Jeong, LF Wan, ES Cho, TW Heo, ... Chemical reviews 118 (22), 10775-10839, 2018 | 403 | 2018 |
| Femtosecond x-ray spectroscopy of an electrocyclic ring-opening reaction AR Attar, A Bhattacherjee, CD Pemmaraju, K Schnorr, KD Closser, ... Science 356 (6333), 54-59, 2017 | 277 | 2017 |
| Metal–oxygen decoordination stabilizes anion redox in Li-rich oxides J Hong, WE Gent, P Xiao, K Lim, DH Seo, J Wu, PM Csernica, CJ Takacs, ... Nature materials 18 (3), 256-265, 2019 | 271 | 2019 |
| Experimental and theoretical investigation of the electronic structure of Cu2O and CuO thin films on Cu(110) using x-ray photoelectron and absorption spectroscopy P Jiang, D Prendergast, F Borondics, S Porsgaard, L Giovanetti, E Pach, ... The Journal of chemical physics 138 (2), 024704, 2013 | 236 | 2013 |
| Efficient implementation of core-excitation Bethe–Salpeter equation calculations K Gilmore, J Vinson, EL Shirley, D Prendergast, CD Pemmaraju, JJ Kas, ... Computer Physics Communications 197, 109-117, 2015 | 185 | 2015 |
| Phase Transformation and Lithiation Effect on Electronic Structure of LixFePO4: An In-Depth Study by Soft X-ray and Simulations X Liu, J Liu, R Qiao, Y Yu, H Li, L Suo, Y Hu, YD Chuang, G Shu, F Chou, ... Journal of the American Chemical Society 134 (33), 13708-13715, 2012 | 176 | 2012 |
| Polysulfide-blocking microporous polymer membrane tailored for hybrid Li-sulfur flow batteries C Li, AL Ward, SE Doris, TA Pascal, D Prendergast, BA Helms Nano letters 15 (9), 5724-5729, 2015 | 171 | 2015 |
| Mg Desolvation and Intercalation Mechanism at the Mo6S8 Chevrel Phase Surface LF Wan, BR Perdue, CA Apblett, D Prendergast Chemistry of Materials 27 (17), 5932-5940, 2015 | 167 | 2015 |
| X-ray absorption spectra of dissolved polysulfides in lithium–sulfur batteries from first-principles TA Pascal, KH Wujcik, J Velasco-Velez, C Wu, AA Teran, M Kapilashrami, ... The journal of physical chemistry letters 5 (9), 1547-1551, 2014 | 153 | 2014 |
| Electronic structure of warm dense copper studied by ultrafast x-ray absorption spectroscopy BI Cho, K Engelhorn, AA Correa, T Ogitsu, CP Weber, HJ Lee, J Feng, ... Physical Review Letters 106 (16), 167601, 2011 | 151 | 2011 |
| Direct and simultaneous observation of ultrafast electron and hole dynamics in germanium M Zürch, HT Chang, LJ Borja, PM Kraus, SK Cushing, A Gandman, ... Nature communications 8 (1), 15734, 2017 | 142 | 2017 |
| On the hydration and hydrolysis of carbon dioxide AH England, AM Duffin, CP Schwartz, JS Uejio, D Prendergast, ... Chemical Physics Letters 514 (4-6), 187-195, 2011 | 138 | 2011 |
| Tuning semiconductor band edge energies for solar photocatalysis via surface ligand passivation S Yang, D Prendergast, JB Neaton Nano letters 12 (1), 383-388, 2012 | 135 | 2012 |
CD PemmarajuIBMVerified email at tcd.ie
