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density functional theory 1electronic structure 1high-performance computing 1open-source software 1plane-wave methods 1pseudopotentials 1

From the 1 of 13 linked papers with an AI index.

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20052019
most citedQuantum ESPRESSO: a modular and open-source software project for quantum simulations of materials

29.3k citations · 38.7k across the 13 of their papers we have counts for

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physics.comp-ph2019★ 40 cited

SIMPLE code: optical properties with optimal basis functions

Gianluca Prandini, Mario Galante, Nicola Marzari +1

We present SIMPLE, a code developed to calculate optical properties of metallic and insulating extended systems using the optimal basis method originally proposed by E. L. Shirley…