Beryllium nitride (Be3N2) graphene like monolayer and zigzag single walled nanotubes. A DFT exploration of their structural and vibrational properties

被引：0
|
作者：
K. Nehdi
T. Larbi
R. Masri
B. Souissi
K. Doll
M. Amlouk
机构：
[1] Universite de Tunis,Laboratoire de Nanomateriaux Nanotechnologie et Energie, Faculte des sciences de Tunis
[2] Université de Tunis,Molpro Quantum Chemistry Software, Institute for Theoretical Chemistry
[3] IPEIT,undefined
[4] University of Stuttgart,undefined
来源：
The European Physical Journal Plus | / 138卷
关键词：
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
相关论文
共 36 条
  • [1] Beryllium nitride (Be3N2) graphene like monolayer and zigzag single walled nanotubes. A DFT exploration of their structural and vibrational properties
    Nehdi, K.
    Larbi, T.
    Masri, R.
    Souissi, B.
    Doll, K.
    Amlouk, M.
    EUROPEAN PHYSICAL JOURNAL PLUS, 2023, 138 (07):
  • [2] DFT study of electronic and structural properties of single-walled gallium nitride nanotubes
    Shabani, Mostafa
    Movlarooy, Tayebeh
    Hessami Pilehrood, Saeid
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2023, 123 (17)
  • [3] Structural, electronic, phonon, and elastic properties of zigzag single-walled and double-walled boron nitride nanotubes
    Abad, Rohollah Zare Hasan
    Badehian, Hojat Allah
    MOLECULAR CRYSTALS AND LIQUID CRYSTALS, 2024, 768 (13) : 591 - 599
  • [4] First principles study of electronic structure and optical properties of beryllium nitride in β phase (β-Be3N2)
    Zarmiento-Garcia, Rubi
    Reyes-Serrato, Armando
    Xiao, Mufei
    OPTIK, 2018, 160 : 109 - 115
  • [5] DFT Study on Structural and Mechanical Properties of Single-walled Carbon and Boron Nitride Nanotubes Functionalized with Carbenes
    Petrushenko, I. K.
    JOURNAL OF NANO- AND ELECTRONIC PHYSICS, 2016, 8 (03)
  • [6] Be3N2 monolayer: A graphene-like two-dimensional material and its derivative nanoribbons
    Chen, Changpeng
    Huang, Bin
    Wu, Jinping
    AIP ADVANCES, 2018, 8 (10)
  • [7] The influence of cations and anions on some structural and electronic properties of single-walled zigzag boron nitride and aluminum nitride nanotubes: a computational study
    Hamid Reza Masoodi
    Ali Ebrahimi
    Sotoodeh Bagheri
    Structural Chemistry, 2015, 26 : 1013 - 1024
  • [8] The influence of cations and anions on some structural and electronic properties of single-walled zigzag boron nitride and aluminum nitride nanotubes: a computational study
    Masoodi, Hamid Reza
    Ebrahimi, Ali
    Bagheri, Sotoodeh
    STRUCTURAL CHEMISTRY, 2015, 26 (04) : 1013 - 1024
  • [9] DFT studies on structural stability, vibrational and linear and nonlinear optical properties of low-dimensional zinc sulfide: from the 3D bulk to the 2D monolayer and the 1D zigzag single-walled nanotubes
    Masri, Rimel
    Larbi, Tarek
    Nehdi, Kamel
    Doll, Klaus
    Amlouk, Mosbah
    PHYSICA SCRIPTA, 2023, 98 (12)
  • [10] HEAT CAPACITY AND THERMODYNAMIC PROPERTIES OF ALPHA-BERYLLIUM NITRIDE, BE3N2, FROM 20 TO 315 K
    FURUKAWA, GT
    REILLY, ML
    JOURNAL OF RESEARCH OF THE NATIONAL BUREAU OF STANDARDS SECTION A-PHYSICS AND CHEMISTRY, 1970, A 74 (05): : 617 - +
1234