Purely one-dimensional ferroelectricity and antiferroelectricity from van der Waals niobium oxide trihalides

Abstract

Abstract Intrinsic one-dimensional (1D) ferroelectric materials are rarely reported but are highly sought to break the size limit of nanostructured conventional ferroelectrics. Herein, we report a class of inborn 1D ferroelectric nanowires, namely 1D NbOX3 (X = Cl, Br, and I), that can be directly obtained from experimentally realized van der Waals crystals. In addition to the sizable spontaneous polarization, 1D NbOX3 exhibits low ferroelectric switching barriers, small coercive electric fields, and high critical temperature, governed by the hybridization of the Nb empty d orbitals and the O p orbitals (d 0 rule). Moreover, the double-channel structure of 1D NbOX3 also enables the emergence of 1D antiferroelectric metastable states. Our findings not only propose a class of 1D ferroelectric materials toward the development of miniaturized and high-density electronic devices, but also pave an avenue of obtaining intrinsic 1D ferroelectrics from van der Waals crystals.