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. 2019 Jul 27;21(8):735. doi: 10.3390/e21080735
CNT Carbon nanotube
DFT Density functional theory
DFTB Density functional tight-binding
DOS Density of states
EOM Equation of motion
GF Green’s functions
LDOS Local density of states
NEGF Non-equilibrium Green’s functions
NEMD Non-equilibrium molecular dynamics
MD Molecular dynamics
PA Poly-acetylene
PE Poly-ethylene
TD Time-dependent