Recent progress on the prediction of two-dimensional materials using CALYPSO
Tang Cheng, Kour Gurpreet, Du Aijun †
       

(a) Predicted structures of AuGaS2 and bandgaps of extended AuMX2 monolayers.[79] (b) Different alloyed configurations of CrWI6 and CrWGe2Te6, and their relative energies.[92] (c) The structures of most stable VSSe and their phonon spectra.[94] Reprinted with permission from Ref. [79], Copyright 2018 American Chemical Society. Ref. [92], Copyright 2018 American Chemical Society. Ref. [94], Copyright 2019 American Chemical Society.