28 citations · 58 across the 7 of their papers we have counts for
7 papers
Tilt-driven ferrielectricity in PbZrO
Huazhang Zhang, Ying Liu, Carson Carroll +6
We reveal a tilt-driven mechanism for ferrielectricity in prototypical antiferroelectric PbZrO. Specifically, introducing an additional octahedral tilt into the antiferroelectr…
Silicon-compatible ideal antiferroelectricity with large digital electromechanical responses enabled by thermal-strain domain engineering
Hao Xiong, Huazhang Zhang, Liang Shu +16
Antiferroelectrics exhibit reversible antipolar-polar transformations, offering a compelling platform for multiple functionalities in modern nanoelectronics, yet deterministic cont…
Abinit 2025: New Capabilities for the Predictive Modeling of Solids and Nanomaterials
Matthieu J. Verstraete, Joao Abreu, Guillaume E. Allemand +71
Abinit is a widely used scientific software package implementing density functional theory and many related functionalities for excited states and response properties. This paper p…
Finite-temperature properties and the hidden ferroelectric phase of bulk CaTiO from second principles
Huazhang Zhang, Michael Marcus Schmitt, Louis Bastogne +2
A second-principles effective interatomic potential is introduced for the prototypical perovskite CaTiO (CTO), relying on a Taylor polynomial expansion of the Born-Oppenheimer…
Vortices and antivortices in antiferroelectric PbZrO3
Ying Liu, Huazhang Zhang, Konstantin Shapovalov +8
Although ferroelectric materials are characterised by their parallel arrangement of electric dipoles, in the right boundary conditions these dipoles can reorganize themselves into…
Lattice-distortion couplings in antiferroelectric perovskite and comparison with
Huazhang Zhang, Konstantin Shapovalov, Safari Amisi +1
Lead-free antiferroelectric perovskite is nowadays attracting extensive research interests due to its promising applications in energy storage. Although great progres…
Finite-temperature properties of antiferroelectric perovskite from deep learning interatomic potential
Huazhang Zhang, Hao-Cheng Thong, Louis Bastogne +3
The prototypical antiferroelectric perovskite (PZO) has garnered considerable attentions in recent years due to its significance in technological applications and fun…