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20182021
most citedGraphdiynes interacting with metal surfaces: first-principles electronic and vibrational properties

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physics.comp-ph2018

GeVn complexes for silicon-based room-temperature single-atom nanoelectronics

Simona Achilli, Nicola Manini, Giovanni Onida +3

We characterize germanium-vacancy GeVn complexes in silicon using first-principles Density Functional Theory calculations with screening-dependent hybrid functionals. We report on…