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Dhara Trivedi
Tytuł
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Global flux surface hopping approach for mixed quantum-classical dynamics
L Wang, D Trivedi, OV Prezhdo
Journal of chemical theory and computation 10 (9), 3598-3605, 2014
1572014
Stretchable nanolasing from hybrid quadrupole plasmons
D Wang, MR Bourgeois, WK Lee, R Li, D Trivedi, MP Knudson, W Wang, ...
Nano letters 18 (7), 4549-4555, 2018
1332018
Efficient removal of per-and polyfluoroalkyl substances from water with zirconium-based metal–organic frameworks
R Li, S Alomari, R Stanton, MC Wasson, T Islamoglu, OK Farha, ...
Chemistry of Materials 33 (9), 3276-3285, 2021
1322021
Nonadiabatic molecular dynamics for thousand atom systems: a tight-binding approach toward PYXAID
S Pal, DJ Trivedi, AV Akimov, B Aradi, T Frauenheim, OV Prezhdo
Journal of chemical theory and computation 12 (4), 1436-1448, 2016
1232016
Optical spin injection and spin lifetime in Ge heterostructures
F Pezzoli, F Bottegoni, D Trivedi, F Ciccacci, A Giorgioni, P Li, S Cecchi, ...
Physical Review Letters 108 (15), 156603, 2012
1222012
Ultrafast removal of phosphate from eutrophic waters using a cerium-based metal–organic framework
MH Hassan, R Stanton, J Secora, DJ Trivedi, S Andreescu
ACS Applied Materials & Interfaces 12 (47), 52788-52796, 2020
1132020
Auger-mediated electron relaxation is robust to deep hole traps: time-domain ab initio study of CdSe quantum dots
DJ Trivedi, L Wang, OV Prezhdo
Nano letters 15 (3), 2086-2091, 2015
712015
Observation of an excitonic quantum coherence in CdSe nanocrystals
S Dong, D Trivedi, S Chakrabortty, T Kobayashi, Y Chan, OV Prezhdo, ...
Nano letters 15 (10), 6875-6882, 2015
392015
Understanding the chemical contribution to the enhancement mechanism in SERS: Connection with Hammett parameters
DJ Trivedi, B Barrow, GC Schatz
The Journal of Chemical Physics 153 (12), 2020
372020
Ab initio quantum dynamics of charge carriers in graphitic carbon nitride nanosheets
S Agrawal, W Lin, OV Prezhdo, DJ Trivedi
The Journal of Chemical Physics 153 (5), 2020
352020
Charge carrier nonadiabatic dynamics in non-metal doped graphitic carbon nitride
S Agrawal, AS Vasenko, DJ Trivedi, OV Prezhdo
The Journal of Chemical Physics 156 (9), 2022
292022
Model for describing plasmonic nanolasers using Maxwell-Liouville equations with finite-difference time-domain calculations
DJ Trivedi, D Wang, TW Odom, GC Schatz
Physical Review A 96 (5), 053825, 2017
262017
Spin-dependent optical properties in strained silicon and germanium
P Li, D Trivedi, H Dery
Physical Review B—Condensed Matter and Materials Physics 87 (11), 115203, 2013
262013
Analysis of the trajectory surface hopping method from the markov state model perspective
AV Akimov, D Trivedi, L Wang, OV Prezhdo
Journal of the Physical Society of Japan 84 (9), 094002, 2015
242015
Influence of Defects and Linker Exchange on Removal of Phosphate Using MOFs with the Node Structure M6(OH)4(O)4 for M = Hf, Zr, or Ce
R Stanton, DJ Trivedi
Chemistry of Materials 33 (14), 5730-5737, 2021
152021
Decoherence allows model reduction in nonadiabatic dynamics simulations
DJ Trivedi, OV Prezhdo
The Journal of Physical Chemistry A 119 (33), 8846-8853, 2015
142015
Influence of vacancy and adsorption of transition metal on performance of single layer of boron pnictides as a supercapacitor electrode: An ab initio investigation
H Kolavada, DJ Trivedi, PN Gajjar, SK Gupta
Journal of Energy Storage 72, 108444, 2023
112023
Investigating the Increased CO2 Capture Performance of Amino Acid Functionalized Nanoporous Materials from First-Principles and Grand Canonical Monte Carlo …
R Stanton, DJ Trivedi
The Journal of Physical Chemistry Letters 14 (21), 5069-5076, 2023
92023
Capture of Toxic Oxoanions from Water Using Metal–Organic Frameworks
R Stanton, E Russell, H Brandt, DJ Trivedi
The Journal of Physical Chemistry Letters 12 (37), 9175-9181, 2021
92021
Charge Carrier Dynamics at the Interface of 2D Metal–Organic Frameworks and Hybrid Perovskites for Solar Energy Harvesting
R Stanton, DJ Trivedi
Nano Letters 23 (24), 11932-11939, 2023
72023
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