TY - JOUR
T1 - Graphyne
T2 - Optical Excitations and Charge Distributions
AU - Madsen, Andreas Ø.
AU - Mikkelsen, Sophia Valentina Kmit
AU - Mikkelsen, Kurt Valentin
PY - 2023
Y1 - 2023
N2 - Graphyne is the new wonder material and the optical transitions and charge distributions of different graphyne fragmewnts are investigated using density functional theory calculations.
AB - Graphyne is the new wonder material and the optical transitions and charge distributions of different graphyne fragmewnts are investigated using density functional theory calculations.
U2 - 10.25177/JCCMM.6.1.RA.10839
DO - 10.25177/JCCMM.6.1.RA.10839
M3 - Journal article
VL - 6
SP - 663
EP - 676
JO - J. Comp. Chem. Mol. Mod.
JF - J. Comp. Chem. Mol. Mod.
IS - 1
ER -