Gallium selenide monolayer (GSM) was recently proposed as a potential two-dimension
material in electronic, spintronic, and optoelectronic applications. This work investigates the
anisotropic mechanical properties and thermal conductivity of the GSM structure using
molecular dynamics (MD) and non-equilibrium MD (NEMD) simulations, which are the key
for designing nanodevices. First, we evaluate the GSM atomistic deformation mechanisms
and mechanical properties influenced by tensile strain rate and temperature under uniaxial …