Comment on “Computational study of H2\documentclass[12pt]{minimal} \usepackage{amsmath} \usepackage{wasysym} \usepackage{amsfonts} \usepackage{amssymb} \usepackage{amsbsy} \usepackage{mathrsfs} \usepackage{upgreek} \setlength{\oddsidemargin}{-69pt} \begin{document}$$_{2}$$\end{document}S adsorption on the pristine and transitional metal-doped phosphorene”

被引：0

作者：

Elham Zare

Ghasem Rezaei

Behrooz Vaseghi

机构：

[1] Yasouj University,Department of Physics, College of Sciences

来源：

关键词：

Phosphorene; Gas adsorption; Transition metal; Density functional theory;

D O I：

10.1007/s00894-022-05255-z

中图分类号：

学科分类号：

摘要：

引用

共 22 条

[1] Hashmi A(2015)Transition metal doped phosphorene: First-principles study J Phys Chem C 119 9198-9204
[2] Hong J(2016)Transition metal and vacancy defect complexes in phosphorene: A spintronic perspective J Phys Chem C 120 14991-15000
[3] Babar R(2015)Atomically thin dilute magnetism in Co-doped phosphorene Phys Rev B 91 15549-15558
[4] Kabir M(2020)Mn-Doped black phosphorene for ultrasensitive hydrogen sulfide detection: periodic DFT calculations Phys Chem Chem Phys 22 3865-undefined
[5] Seixas L(2009)Quantum espresso: A modular and opensource software project for quantum simulations of materials J Phys Condens Matter 21 5188-undefined
[6] Carvalho A(1996)Generalized gradient approximation made simple Phys Rev Lett 77 undefined-undefined
[7] Castro Neto AH(1976)Special points for Brillouin-zone integrations Phys Rev B 13 undefined-undefined
[8] Ghadiri M(2014)Physical adsorption: Theory of van der waals interactions between particles and clean surfaces Phys Rev Lett 112 undefined-undefined
[9] Ghashghaee M(undefined)undefined undefined undefined undefined-undefined
[10] Ghambarian M(undefined)undefined undefined undefined undefined-undefined