Performance of heterogeneous computing with graphics processing unit and many integrated core for hartree potential calculations on a numerical grid

von Choi, Sunghwan
Veröffentlicht in: Journal of computational chemistry (2016)

Carbon nanotube, graphene, nanowire, and molecule-based electron and spin transport phenomena using the nonequilibrium Green's function method at the level of first principles theo...

von Kim, Woo Youn
Veröffentlicht in: Journal of computational chemistry (2008)