Dispersed VO 2 phases in a flexible sensor for recognizing tensile and compressive stress

T Huang, M Qiu, P Xu, W Yang, L Zhang… - Journal of Materials …, 2023‏ - pubs.rsc.org
Stress recognition has been exploited in flexible sensors and has attracted considerable
attention in the fields of electronic skins and intelligent robots towards artificial intelligence …

An activity descriptor for perovskite oxides in catalysis

D Xu, W Qu, X Gu, M Li, R Liu, Y Dong, Z Ma, Y Chen… - Chem Catalysis, 2022‏ - cell.com
Perovskite oxides are a class of important metal oxide catalysts, the activities of which are
explained largely by the delocalized band descriptor and the local orbital descriptor that are …

First-principles investigation of physical properties of transition metal-based ternary TM5Si3C (TM= Nb, Mo, Ta, W) silicides of nowotny phase

AW Aslam, MN Rasul, A Hussain, MA Rafiq… - Journal of Physics and …, 2024‏ - Elsevier
In this work, the structural, electronic, mechanical, elastic anisotropy, thermodynamic, and
optical properties of TM 5 Si 3 C silicides have been examined using first-principles …

The role of epitaxial strain on photoconductive performance in LaNiO3 epitaxial thin films

J Li, H Liu, H Wu, J Yang, T Deng, S Liu, R **e… - Ceramics …, 2023‏ - Elsevier
In this work, LaNiO 3 epitaxial thin films on (001) single-crystal LaAlO 3 and SrTiO 3
substrates were deposited by polymer assisted deposition method, respectively …

A first-principles study of the properties of four predicted novel phases of AlN

R Yang, C Zhu, Q Wei, Z Du - Journal of Physics and Chemistry of Solids, 2017‏ - Elsevier
Structural, elastic, thermodynamic, electronic and optical properties of four predicted novel
AlN phases (Pmn2 1-AlN, Pbam-AlN, Pbca-AlN and Cmcm-AlN) are calculated using first …

Study of Negative Permittivity in Nanosized LaNiO3 for Electromagnetic Interference Shielding: A Modified Drude Model Approach

T Katheriya, G Nirala, S Upadhyay - ACS Applied Electronic …, 2025‏ - ACS Publications
Addressing the growing concern of electromagnetic (EM) pollution requires the development
of advanced electromagnetic interference (EMI) shielding materials. This study investigates …

Metal-to-semiconductor transitions and optical properties of ReNiO3 superlattices: An integration of first-principles calculations and machine learning analysis

Y Cui, C Zhang, L Niu, X Tang, Z Luo, G Le… - Surfaces and Interfaces, 2024‏ - Elsevier
Engineering the physical properties of rare-earth nickelates (ReNiO 3) through superlattice
engineering is a highly promising approach. This study focuses on the electronic …

Strain induced variations in transport and optical properties of SrVO3: a DFT + U study

M Biswas, D Misra, TK Kundu - The European Physical Journal B, 2023‏ - Springer
First-principles calculations based on density functional theory+ Hubbard U (DFT+ U)
approach have been carried out to study the strain induced variations in the optical and …

First-principles study on the magnetic properties in non-metallic co-doped cubic LaNiO3

L Zheng, Y Wang, F Chen, R Chen, Y Liu - Solid State Communications, 2023‏ - Elsevier
Using the first principles spin polarized calculations, the electronic structures and magnetic
properties of two C atoms and two S atoms doped LaNiO 3 (LNO) are investigated. For the …

Transport properties and metal–insulator transition in oxygen deficient LaNiO3: A density functional theory study

D Misra, TK Kundu - Materials Research Express, 2016‏ - iopscience.iop.org
Density functional theory with appropriate functional has been employed to investigate the
metal to insulator transition in oxygen deficient LaNiO 3–x (x= 0.0, 0.25, 0.5, 1.0) …