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Evan J Reed

Showing results (41-50 of 66) with videos related to

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The Journal of Chemical Physics|January 10, 2019
ODE integration schemes for plane-wave real-time time-dependent density functional theoryDaniel A Rehn, Yuan Shen, Marika E Buchholz, et al.
The Journal of Physical Chemistry Letters|November 28, 2018
Revealing the Spectrum of Unknown Layered Materials with Superhuman Predictive AbilitiesGowoon Cheon, Ekin D Cubuk, Evan R Antoniuk, et al.
The Journal of Physical Chemistry. A|October 8, 2013
Comparison of ReaxFF, DFTB, and DFT for phenolic pyrolysis. 2. Elementary reaction pathsCharles W Bauschlicher, Tingting Qi, Evan J Reed, et al.
The Journal of Physical Chemistry. A|February 9, 2019
Transferable Kinetic Monte Carlo Models with Thousands of Reactions Learned from Molecular Dynamics SimulationsEnze Chen, Qian Yang, Vincent Dufour-Décieux, et al.
Nano Letters|February 14, 2017
Data Mining for New Two- and One-Dimensional Weakly Bonded Solids and Lattice-Commensurate HeterostructuresGowoon Cheon, Karel-Alexander N Duerloo, Austin D Sendek, et al.
Advanced Materials (Deerfield Beach, Fla.)|September 12, 2021
Novel Ultrabright and Air-Stable Photocathodes Discovered from Machine Learning and Density Functional Theory Driven ScreeningEvan R Antoniuk, Peter Schindler, W Andreas Schroeder, et al.
ACS Applied Materials & Interfaces|September 8, 2023
Electrolyte Coatings for High Adhesion Interfaces in Solid-State Batteries from First PrinciplesBrandi Ransom, Akash Ramdas, Eder Lomeli, et al.
ACS Nano|May 28, 2021
Spectrum of Exfoliable 1D van der Waals Molecular Wires and Their Electronic PropertiesYanbing Zhu, Daniel A Rehn, Evan R Antoniuk, et al.
The Journal of Chemical Physics|April 2, 2009
Ab initio simulation of the equation of state and kinetics of shocked waterNir Goldman, Evan J Reed, I-F William Kuo, et al.
The Journal of Chemical Physics|June 6, 2008
Ultrafast transformation of graphite to diamond: an ab initio study of graphite under shock compressionChristopher J Mundy, Alessandro Curioni, Nir Goldman, et al.
Pageof 7

Showing results (41-50 of 66) with videos related to

Sort By:
Pageof 7
The Journal of Chemical Physics|January 10, 2019
ODE integration schemes for plane-wave real-time time-dependent density functional theoryDaniel A Rehn, Yuan Shen, Marika E Buchholz, et al.
The Journal of Physical Chemistry Letters|November 28, 2018
Revealing the Spectrum of Unknown Layered Materials with Superhuman Predictive AbilitiesGowoon Cheon, Ekin D Cubuk, Evan R Antoniuk, et al.
The Journal of Physical Chemistry. A|October 8, 2013
Comparison of ReaxFF, DFTB, and DFT for phenolic pyrolysis. 2. Elementary reaction pathsCharles W Bauschlicher, Tingting Qi, Evan J Reed, et al.
The Journal of Physical Chemistry. A|February 9, 2019
Transferable Kinetic Monte Carlo Models with Thousands of Reactions Learned from Molecular Dynamics SimulationsEnze Chen, Qian Yang, Vincent Dufour-Décieux, et al.
Nano Letters|February 14, 2017
Data Mining for New Two- and One-Dimensional Weakly Bonded Solids and Lattice-Commensurate HeterostructuresGowoon Cheon, Karel-Alexander N Duerloo, Austin D Sendek, et al.
Advanced Materials (Deerfield Beach, Fla.)|September 12, 2021
Novel Ultrabright and Air-Stable Photocathodes Discovered from Machine Learning and Density Functional Theory Driven ScreeningEvan R Antoniuk, Peter Schindler, W Andreas Schroeder, et al.
ACS Applied Materials & Interfaces|September 8, 2023
Electrolyte Coatings for High Adhesion Interfaces in Solid-State Batteries from First PrinciplesBrandi Ransom, Akash Ramdas, Eder Lomeli, et al.
ACS Nano|May 28, 2021
Spectrum of Exfoliable 1D van der Waals Molecular Wires and Their Electronic PropertiesYanbing Zhu, Daniel A Rehn, Evan R Antoniuk, et al.
The Journal of Chemical Physics|April 2, 2009
Ab initio simulation of the equation of state and kinetics of shocked waterNir Goldman, Evan J Reed, I-F William Kuo, et al.
The Journal of Chemical Physics|June 6, 2008
Ultrafast transformation of graphite to diamond: an ab initio study of graphite under shock compressionChristopher J Mundy, Alessandro Curioni, Nir Goldman, et al.
Pageof 7