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Journal of Chemical Theory and Computation
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April 2, 2019
An ab Initio Linear Response Method for Computing Magnetic Circular Dichroism Spectra with Nonperturbative Treatment of Magnetic Field
Shichao Sun, David Williams-Young, Xiaosong Li
Journal of Chemical Theory and Computation
|
September 27, 2016
Relativistic Two-Component Particle-Particle Tamm-Dancoff Approximation
David Williams-Young, Franco Egidi, Xiaosong Li
Journal of Chemical Theory and Computation
|
October 18, 2016
Accelerating Real-Time Time-Dependent Density Functional Theory with a Nonrecursive Chebyshev Expansion of the Quantum Propagator
David Williams-Young, Joshua J Goings, Xiaosong Li
Journal of Chemical Theory and Computation
|
October 3, 2019
Simulating Magnetic Circular Dichroism Spectra with Real-Time Time-Dependent Density Functional Theory in Gauge Including Atomic Orbitals
Shichao Sun, Ryan A Beck, David Williams-Young, et al.
Journal of Chemical Theory and Computation
|
January 17, 2022
The Effect of Geometry, Spin, and Orbital Optimization in Achieving Accurate, Correlated Results for Iron-Sulfur Cubanes
Carlos Mejuto-Zaera, Demeter Tzeli, David Williams-Young, et al.
The Journal of Chemical Physics
|
May 12, 2023
PluginPlay: Enabling exascale scientific software one module at a time
Ryan M Richard, Kristopher Keipert, Jonathan Waldrop, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
April 2, 2019
An ab Initio Linear Response Method for Computing Magnetic Circular Dichroism Spectra with Nonperturbative Treatment of Magnetic Field
Shichao Sun, David Williams-Young, Xiaosong Li
Journal of Chemical Theory and Computation
|
September 27, 2016
Relativistic Two-Component Particle-Particle Tamm-Dancoff Approximation
David Williams-Young, Franco Egidi, Xiaosong Li
Journal of Chemical Theory and Computation
|
October 18, 2016
Accelerating Real-Time Time-Dependent Density Functional Theory with a Nonrecursive Chebyshev Expansion of the Quantum Propagator
David Williams-Young, Joshua J Goings, Xiaosong Li
Journal of Chemical Theory and Computation
|
October 3, 2019
Simulating Magnetic Circular Dichroism Spectra with Real-Time Time-Dependent Density Functional Theory in Gauge Including Atomic Orbitals
Shichao Sun, Ryan A Beck, David Williams-Young, et al.
Journal of Chemical Theory and Computation
|
January 17, 2022
The Effect of Geometry, Spin, and Orbital Optimization in Achieving Accurate, Correlated Results for Iron-Sulfur Cubanes
Carlos Mejuto-Zaera, Demeter Tzeli, David Williams-Young, et al.
The Journal of Chemical Physics
|
May 12, 2023
PluginPlay: Enabling exascale scientific software one module at a time
Ryan M Richard, Kristopher Keipert, Jonathan Waldrop, et al.
Page
of 1