Zobrazeno 1 - 10
of 123
pro vyhledávání: '"Timothy C. Berkelbach"'
Publikováno v:
Physical Review Research, Vol 5, Iss 2, p 023101 (2023)
The use of neural network parametrizations to represent the ground state in variational Monte Carlo (VMC) calculations has generated intense interest in recent years. However, as we demonstrate in the context of the periodic Heisenberg spin chain, th
Externí odkaz:
https://doaj.org/article/33b27c1a32ac498884b815f87d1d83c9
Autor:
Roel Tempelaar, Timothy C. Berkelbach
Publikováno v:
Nature Communications, Vol 10, Iss 1, Pp 1-7 (2019)
2D electronic spectroscopy found experimental indications of coherently interacting excitons and trions in doped transition metal dichalcogenides (TMDCs). Here, the authors perform simulations of 2D spectra of monolayer TMDCs based on a many-body for
Externí odkaz:
https://doaj.org/article/6842c98c73da422287eeed0d1deba254
Autor:
Taketo Handa, Petra Shih, Christie S. Koay, Colin Nuckolls, Xavier Roy, Timothy C. Berkelbach, Xiaoyang Zhu
Publikováno v:
The Journal of Physical Chemistry C. 127:1519-1526
Autor:
Boyuan Zhang, Cedric Schaack, Claudia R. Prindle, Ethan A. Vo, Miriam Aziz, Michael L. Steigerwald, Timothy C. Berkelbach, Colin Nuckolls, Latha Venkataraman
Publikováno v:
Chemical Science. 14:1769-1774
We demonstrate that electric fields can homolytically cleave a peroxide bond in different solvents with a rate that is proportional to the solvent dielectric constant.
Autor:
Archana Raja, Andrey Chaves, Jaeeun Yu, Ghidewon Arefe, Heather M. Hill, Albert F. Rigosi, Timothy C. Berkelbach, Philipp Nagler, Christian Schüller, Tobias Korn, Colin Nuckolls, James Hone, Louis E. Brus, Tony F. Heinz, David R. Reichman, Alexey Chernikov
Publikováno v:
Nature Communications, Vol 8, Iss 1, Pp 1-7 (2017)
Electronic bandgap tuning in semiconductors enables key functionalities in solid-state devices. Here, the authors present a strategy to control the bandgap of atomically thin WS2 and WSe2semiconductors via manipulation of the surrounding dielectric e
Externí odkaz:
https://doaj.org/article/a5b39dc701f44ba1966f1cdb0631887c
Publikováno v:
ACS Catalysis. 12:8237-8241
The use of electric fields to modify chemical reactions is a promising, emerging technique in catalysis. However, there exist few guiding principles, and rational design requires assumptions about the transition state or explicit atomistic calculatio
Publikováno v:
Journal of Chemical Theory and Computation. 18:3438-3446
Inspired by Grimme's simplified Tamm-Dancoff density functional theory approach [Grimme, S.
Autor:
Jonas D. Ziegler, Yeongsu Cho, Sophia Terres, Matan Menahem, Takashi Taniguchi, Kenji Watanabe, Omer Yaffe, Timothy C. Berkelbach, Alexey Chernikov
Publikováno v:
Advanced Materials. 35
Publikováno v:
Physical Review B. 107
Autor:
Michael S. Chen, Joonho Lee, Hong-Zhou Ye, Timothy C. Berkelbach, David R. Reichman, Thomas E. Markland
Publikováno v:
Journal of Chemical Theory and Computation.