David Prendergast
TitleCited byYear
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, 2015
5532015
X-ray absorption spectra of water from first principles calculations
D Prendergast, G Galli
Physical review letters 96 (21), 215502, 2006
3462006
Attosecond band-gap dynamics in silicon
M Schultze, K Ramasesha, CD Pemmaraju, SA Sato, D Whitmore, ...
Science 346 (6215), 1348-1352, 2014
2882014
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
1902014
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
1272012
Bound excitons in metallic single-walled carbon nanotubes
J Deslippe, CD Spataru, D Prendergast, SG Louie
Nano letters 7 (6), 1626-1630, 2007
1192007
The electronic structure of liquid water within density-functional theory
D Prendergast, JC Grossman, G Galli
The Journal of chemical physics 123 (1), 014501, 2005
1072005
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
1062011
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, 2018
1052018
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
1052014
Strain-induced band gap modification in coherent core/shell nanostructures
S Yang, D Prendergast, JB Neaton
Nano letters 10 (8), 3156-3162, 2010
1042010
Imaging local electronic corrugations and doped regions in graphene
BJ Schultz, CJ Patridge, V Lee, C Jaye, PS Lysaght, C Smith, J Barnett, ...
Nature communications 2, 372, 2011
972011
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
962017
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
962017
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
922015
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
922011
Tuning semiconductor band edge energies for solar photocatalysis via surface ligand passivation
S Yang, D Prendergast, JB Neaton
Nano letters 12 (1), 383-388, 2011
912011
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
892015
Electronic bonding transition in compressed SiO 2 glass
JF Lin, H Fukui, D Prendergast, T Okuchi, YQ Cai, N Hiraoka, CS Yoo, ...
Physical Review B 75 (1), 012201, 2007
892007
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
872013
The system can't perform the operation now. Try again later.
Articles 1–20