Fig. 4: Effect of the number of configurations on energy conservation. | npj Computational Materials

Fig. 4: Effect of the number of configurations on energy conservation.

From: Atomistic simulations of out-of-equilibrium quantum nuclear dynamics

Fig. 4: Effect of the number of configurations on energy conservation.The alternative text for this image may have been generated using AI.

a Energy conservation of the GV method as a function of the number of configurations Nc in the uncorrelated formulation. b Energy conservation in the correlated formulation. Note that the y-scale of the two panels differ by more than two orders of magnitudes.

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