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RPA calculations with Yambo for large systems


RPA calculations with Yambo for large systems

random_phase_approximation_ring_diagrams

Performing RPA calculations with yambo in large systems can be a problem due to the memory requirement. In fact the code does not distribute the dielectric constant at the different frequencies among the processors. The solution is to run different calculations for each frequency of the dielectric constant and then joind the outputs. Here my… Read More

Théorie et Simulation Numérique at CINaM