Session L
L43. First-principles modeling of excited-state phenomena in materials VII: Electronic excitations: DFT and Beyond
L43.00002: Towards a systematic multi-scale method for excitations in molecular materials in the BigDFT code
Martina Stella, Laura Ratcliff, Luigi Genovese
L43.00007: Density Functional Theory-based study of charge transfer in doped silicon nanowire with gold leads: A toy model for the p-n junction photovoltaic device
Nathan Walker, Dmitri Kilin, Andrei Kryjevski
L43.00008: HJ-Aggregate Theory Applied to Interacting SP3-Hybridization Defects in Carbon Nanotubes
Braden Weight, Andrew Sifain, Brendan Gifford, Svetlana Kilina, Sergei Tretiak