Works citing this work

6 works

Work: Nosé–Hoover chains: The canonical ensemble via continuous dynamics

1. A Halide‐Based Perovskite CsGeX₃ (X = Cl, Br, and I) for Optoelectronic and Piezoelectric Applications

   L. Celestine, R. Zosiamliana, Shivraj Gurung +4

   ArticlePerovskite Materials and ApplicationsAdvanced Theory and Simulations20231 citations

   ABIABI:AkademIndex/openalex/2023.article.000150

2. First-principles study of line-defect-embedded zigzag graphene nanoribbons: electronic and magnetic properties

   Zhaoyong Guan, Si Chen, Shuanglin Hu +1

   ArticleGraphene research and applicationsPhysical Chemistry Chemical Physics20160 citations

   ABIABI:AkademIndex/openalex/2016.article.000062

3. Collision cascades interact with an edge dislocation in bcc Fe: a molecular dynamics study

   Hao Wang, Jiting Tian, Wei Zhou +3

   ArticleFusion materials and technologiesRSC Advances20180 citations

   ABIABI:AkademIndex/openalex/2018.article.000090

4. Prediction of the Au₄S crystal <i>via</i> a superatom network model: from clusters to solids

   Qiman Liu, Chengyu Zhang, Chang Xu +2

   ArticleNanocluster Synthesis and ApplicationsPhysical Chemistry Chemical Physics20200 citations

   ABIABI:AkademIndex/openalex/2020.article.000403

5. Hybrid-DFT study of halide perovskites, an energy-efficient material under compressive pressure for piezoelectric applications

   L. Celestine, R. Zosiamliana, Lalrin Kima +6

   ArticlePerovskite Materials and ApplicationsJournal of Physics Condensed Matter20240 citations

   ABIABI:AkademIndex/openalex/2024.article.000612

6. In-Plane Hybrid Structure of h-BN and Graphene for Hydrogen Storage Application: A First-Principles Density Functional Theory Study

   B. Chettri, P. K. Patra, Y. T. Singh +6

   ArticleHydrogen Storage and MaterialsEnergy & Fuels20240 citations

   ABIABI:AkademIndex/openalex/2024.article.000624