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1.
First-principles investigation of electronic, mechanical and thermoelectric properties of graphene-like XBi (X = Si, Ge, Sn) monolayers.
Phys Chem Chem Phys
; 23(21): 12471-12478, 2021 Jun 02.
Artículo
en Inglés
| MEDLINE | ID: mdl-34037032
2.
Electronic and optical properties of two-dimensional heterostructures and heterojunctions between doped-graphene and C- and N-containing materials.
Phys Chem Chem Phys
; 23(8): 4865-4873, 2021 Feb 28.
Artículo
en Inglés
| MEDLINE | ID: mdl-33615321
3.
A First-Principles Study of C3 N Nanostructures: Control and Engineering of the Electronic and Magnetic Properties of Nanosheets, Tubes and Ribbons.
Chemphyschem
; 21(2): 164-174, 2020 01 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-31705615
4.
Tunable electronic properties of the dynamically stable layered mineral Pt2HgSe3 (Jacutingaite).
Phys Chem Chem Phys
; 22(42): 24471-24479, 2020 Nov 14.
Artículo
en Inglés
| MEDLINE | ID: mdl-33089277
5.
Control of C3N4 and C4N3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms.
Phys Chem Chem Phys
; 22(4): 2249-2261, 2020 Jan 28.
Artículo
en Inglés
| MEDLINE | ID: mdl-31916563
6.
Embedding of atoms into the nanopore sites of the C6N6 and C6N8 porous carbon nitride monolayers with tunable electronic properties.
Phys Chem Chem Phys
; 22(11): 6418-6433, 2020 Mar 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-32149297
7.
Tuning the electronic and magnetic properties of antimonene nanosheets via point defects and external fields: first-principles calculations.
Phys Chem Chem Phys
; 21(20): 10552-10566, 2019 May 28.
Artículo
en Inglés
| MEDLINE | ID: mdl-31073575
8.
Introducing novel electronic and magnetic properties in C3N nanosheets by defect engineering and atom substitution.
Phys Chem Chem Phys
; 21(37): 21070-21083, 2019 Oct 07.
Artículo
en Inglés
| MEDLINE | ID: mdl-31528958
9.
Reply to the 'Comment on "Two-dimensional penta-like PdPSe with a puckered pentagonal structure: a first-principles study"' by S. Chowdhury, F. Shojaei and B. Mortazavi, Phys. Chem. Chem. Phys., 2023, 25, DOI: 10.1039/D2CP01587K.
Phys Chem Chem Phys
; 25(12): 8966-8968, 2023 Mar 22.
Artículo
en Inglés
| MEDLINE | ID: mdl-36892178
10.
Puckered Penta-like PdPX (X = O, S, Te) Semiconducting Nanosheets: First-Principles Study of the Mechanical, Electro-Optical, and Photocatalytic Properties.
ACS Appl Mater Interfaces
; 14(18): 21577-21584, 2022 May 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-35471020
11.
Semiconducting Chalcogenide Alloys Based on the (Ge, Sn, Pb) (S, Se, Te) Formula with Outstanding Properties: A First-Principles Calculation Study.
ACS Omega
; 6(14): 9433-9441, 2021 Apr 13.
Artículo
en Inglés
| MEDLINE | ID: mdl-33869923
12.
Dirac half-metallicity of Thin PdCl3 Nanosheets: Investigation of the Effects of External Fields, Surface Adsorption and Defect Engineering on the Electronic and Magnetic Properties.
Sci Rep
; 10(1): 213, 2020 Jan 14.
Artículo
en Inglés
| MEDLINE | ID: mdl-31937833
13.
The mechanical, electronic, optical and thermoelectric properties of two-dimensional honeycomb-like of XSb (X = Si, Ge, Sn) monolayers: a first-principles calculations.
RSC Adv
; 10(51): 30398-30405, 2020 Aug 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-35516017
14.
Investigation of strain and doping on the electronic properties of single layers of C6N6 and C6N8: a first principles study.
RSC Adv
; 10(46): 27743-27751, 2020 Jul 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-35516966
15.
Two-dimensional silicon bismotide (SiBi) monolayer with a honeycomb-like lattice: first-principles study of tuning the electronic properties.
RSC Adv
; 10(53): 31894-31900, 2020 Aug 26.
Artículo
en Inglés
| MEDLINE | ID: mdl-35518134
16.
Correction: The mechanical, electronic, optical and thermoelectric properties of two-dimensional honeycomb-like of XSb (X = Si, Ge, Sn) monolayers: a first-principles calculations.
RSC Adv
; 10(52): 31526, 2020 Aug 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-35532425
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