Transition Metal Carbo‐Chalcogenide “TMCC:” A New Family of 2D Materials

Abstract Here, a new family of 2D transition metal carbo‐chalcogenides (TMCCs) is reported, which can be considered a combination of two well‐known families, TM carbides (MXenes) and TM dichalcogenides (TMDCs), at the atomic level. Single sheets are successfully obtained from multilayered Nb 2 S 2 C and Ta 2 S 2 C using electrochemical lithiation followed by sonication in water. The parent multilayered TMCCs are synthesized using a simple, scalable solid‐state synthesis followed by a topochemical reaction. Superconductivity transition is observed at 7.55 K for Nb 2 S 2 C. The delaminated Nb 2 S 2 C outperforms both multilayered Nb 2 S 2 C and delaminated NbS 2 as an electrode material for Li‐ion batteries. Ab initio calculations predict the elastic constant of TMCC to be over 50% higher than that of TMDC.