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Table 2 Comparative summary of adsorption of molecules (adsorption energies in eV) on different 2D surfaces collected from literature vs on the penta-graphene surface

From: Penta-Graphene as a Potential Gas Sensor for NOx Detection

Surface

Molecules

CO

CO2

NH3

NO

NO2

Penta-graphene

− 0.05

− 0.10

− 0.11

− 0.44

− 0.75

Graphene [30, 37]

− 0.01

− 0.05

− 0.03

− 0.03

− 0.07

Silicene [38]

− 0.18

− 0.04

− 0.60

− 0.35

− 1.37

Germanene [39, 40]

− 0.16

− 0.10

− 0.44

− 0.51

− 1.08

Phosphorene [36]

− 0.32

− 0.41

− 0.50

− 0.86

− 0.60

MoS2 [41, 42]

− 0.44

− 0.33

− 0.16

− 0.55

− 0.14

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