Two-dimensional (2D) Janus materials due to their asymmetric structures show fascinating
spintronic and piezoelectric properties making them a research hot spot in recent years. In …

In this article, using first-principles calculations, we propose XMSiY 2 (X= S, Se; M= Mo, W;
and Y= N, P) monolayers as a Janus form of MA 2 Z 4 family and investigate their electronic …

In this paper, based on first principles calculations, we propose functionalization of group-III
monochalcogenides with halogen atoms to form Janus MXY (M= Al, Ga, In; X= Se, Te; Y= Br …

Abstract Janus two-dimensional (2D) materials with asymmetric structures and intrinsic
dipole moments have recently drawn enormous attention due to their appealing …

MXenes are a new two-dimensional materials with potential applications in electrochemical
energy storage. The electronic and optical properties and quantum capacitance of pristine Ti …

In this article, we investigate the potential feasibility of new Janus XMPYS (X= Se, Te; M=
Mo, W; Ydouble bondAl, Ga) monolayers using first-principles calculations. All eight studied …

Exploiting Janus monolayers in constructing two-dimensional van der Waals (vdW)
heterostructures has emerged as an effective strategy for designing highly efficient …

In this article, we investigate the structural, electronic and photocatalytic properties of
XMoSiP2/BP (X= S, Se) heterojunctions using density functional theory. The stability of these …

در این مقاله با استفاده از نظریه تابع چگالی خواص ساختاری، الکترونیکی و نورکاتالیستیِ
پیوندهای XMoSiP2/BP (X= S, Se) را بررسی میکنیم. پایداریِ این ساختارها توسط پراکندگی …‎

In this article, using first-principles calculations, we propose XMSiY2 (X= S, Se; M= Mo, W;
and Y= N, P) monolayers as a Janus form of MA2Z4 family and investigate their electronic …