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The Journal of Chemical Physics
|
September 8, 2019
Efficient formulation of full configuration interaction quantum Monte Carlo in a spin eigenbasis via the graphical unitary group approach
Werner Dobrautz, Simon D Smart, Ali Alavi
Journal of Chemical Theory and Computation
|
January 26, 2016
Combining the Complete Active Space Self-Consistent Field Method and the Full Configuration Interaction Quantum Monte Carlo within a Super-CI Framework, with Application to Challenging Metal-Porphyrins
Giovanni Li Manni, Simon D Smart, Ali Alavi
The Journal of Chemical Physics
|
October 10, 2015
An excited-state approach within full configuration interaction quantum Monte Carlo
N S Blunt, Simon D Smart, George H Booth, et al.
The Journal of Chemical Physics
|
May 17, 2015
Semi-stochastic full configuration interaction quantum Monte Carlo: Developments and application
N S Blunt, Simon D Smart, J A F Kersten, et al.
The Journal of Chemical Physics
|
July 28, 2020
NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods
Kai Guther, Robert J Anderson, Nick S Blunt, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
September 8, 2019
Efficient formulation of full configuration interaction quantum Monte Carlo in a spin eigenbasis via the graphical unitary group approach
Werner Dobrautz, Simon D Smart, Ali Alavi
Journal of Chemical Theory and Computation
|
January 26, 2016
Combining the Complete Active Space Self-Consistent Field Method and the Full Configuration Interaction Quantum Monte Carlo within a Super-CI Framework, with Application to Challenging Metal-Porphyrins
Giovanni Li Manni, Simon D Smart, Ali Alavi
The Journal of Chemical Physics
|
October 10, 2015
An excited-state approach within full configuration interaction quantum Monte Carlo
N S Blunt, Simon D Smart, George H Booth, et al.
The Journal of Chemical Physics
|
May 17, 2015
Semi-stochastic full configuration interaction quantum Monte Carlo: Developments and application
N S Blunt, Simon D Smart, J A F Kersten, et al.
The Journal of Chemical Physics
|
July 28, 2020
NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods
Kai Guther, Robert J Anderson, Nick S Blunt, et al.
Page
of 1