Detalhe da pesquisa
1.
Stability, Chemical Bonding, and Electron Lone Pair Localization in AsN at High Pressure by Density Functional Theory Calculations.
Inorg Chem
; 63(18): 8142-8154, 2024 May 06.
Artigo
Inglês
| MEDLINE | ID: mdl-38640445
2.
First-principles study on structural stabilities, mechanical properties, and biaxial strain-induced superconductivity in Janus MoWC monolayer.
Phys Chem Chem Phys
; 2024 Jun 05.
Artigo
Inglês
| MEDLINE | ID: mdl-38835236
3.
Biaxial stress and functional groups (T = O, F, and Cl) tuning the structural, mechanical, and electronic properties of monolayer molybdenum carbide.
Phys Chem Chem Phys
; 24(29): 17862-17869, 2022 Jul 27.
Artigo
Inglês
| MEDLINE | ID: mdl-35851907
4.
High pressure-induced distortion in face-centered cubic phase of thallium.
Proc Natl Acad Sci U S A
; 113(40): 11143-11147, 2016 10 04.
Artigo
Inglês
| MEDLINE | ID: mdl-27655891
5.
Theoretical aspects in structural distortion and the electronic properties of lithium peroxide under high pressure.
Phys Chem Chem Phys
; 20(14): 9488-9497, 2018 Apr 04.
Artigo
Inglês
| MEDLINE | ID: mdl-29568830
6.
Revealing an unusual transparent phase of superhard iron tetraboride under high pressure.
Proc Natl Acad Sci U S A
; 111(48): 17050-3, 2014 Dec 02.
Artigo
Inglês
| MEDLINE | ID: mdl-25404295
7.
Modified silica-based double-layered hydrophobic-coated stainless steel mesh and its application for oil/seawater separation.
Sci Rep
; 14(1): 731, 2024 Jan 06.
Artigo
Inglês
| MEDLINE | ID: mdl-38184703
8.
Diffusion probabilistic models enhance variational autoencoder for crystal structure generative modeling.
Sci Rep
; 14(1): 1275, 2024 Jan 13.
Artigo
Inglês
| MEDLINE | ID: mdl-38218957
9.
Metal-insulator transition effect on Graphene/VO[Formula: see text] heterostructure via temperature-dependent Raman spectroscopy and resistivity measurement.
Sci Rep
; 14(1): 4545, 2024 Feb 24.
Artigo
Inglês
| MEDLINE | ID: mdl-38402274
10.
First-principles demonstration of band filling-induced significant improvement in thermodynamic stability and mechanical properties of Sc[Formula: see text]Ta[Formula: see text]B[Formula: see text] solid solutions.
Sci Rep
; 13(1): 10504, 2023 Jun 28.
Artigo
Inglês
| MEDLINE | ID: mdl-37380870
11.
Phonon-mediated superconductivity in [Formula: see text] compounds: a crystal prediction via cluster expansion and particle-swarm optimization.
Sci Rep
; 13(1): 20295, 2023 Nov 20.
Artigo
Inglês
| MEDLINE | ID: mdl-37985841
12.
Phase transformations and vibrational properties of hybrid organic-inorganic perovskite MAPbI3 bulk at high pressure.
Sci Rep
; 13(1): 16854, 2023 Oct 06.
Artigo
Inglês
| MEDLINE | ID: mdl-37803050
13.
Waste plastics derived nickel-palladium alloy filled carbon nanotubes for hydrogen evolution reaction.
Chemosphere
; 341: 139982, 2023 Nov.
Artigo
Inglês
| MEDLINE | ID: mdl-37648169
14.
Stabilizing superconductivity of ternary metal pentahydride [Formula: see text] via electronic topological transitions under high pressure from first principles evolutionary algorithm.
Sci Rep
; 12(1): 6700, 2022 Apr 25.
Artigo
Inglês
| MEDLINE | ID: mdl-35468975
15.
Solid-state modification of tapioca starch using atmospheric nonthermal dielectric barrier discharge argon and helium plasma.
Food Res Int
; 162(Pt A): 111961, 2022 12.
Artigo
Inglês
| MEDLINE | ID: mdl-36461286
16.
Superconducting Gap of Pressure Stabilized (Al0.5Zr0.5)H3 from Ab Initio Anisotropic Migdal-Eliashberg Theory.
ACS Omega
; 7(32): 28190-28197, 2022 Aug 16.
Artigo
Inglês
| MEDLINE | ID: mdl-35990471
17.
Presence and absence of intrinsic magnetism in graphitic carbon nitrides designed through C-N-H building blocks.
Sci Rep
; 12(1): 2343, 2022 Feb 11.
Artigo
Inglês
| MEDLINE | ID: mdl-35149743
18.
Effect of Pulse Electrodeposition Parameters on the Microstructure and Mechanical Properties of Ni-W/B Nanocomposite Coatings.
Nanomaterials (Basel)
; 12(11)2022 May 30.
Artigo
Inglês
| MEDLINE | ID: mdl-35683728
19.
Lattice dynamic stability and electronic structures of ternary hydrides La1-x Y x H3 via first-principles cluster expansion.
RSC Adv
; 12(41): 26808-26814, 2022 Sep 16.
Artigo
Inglês
| MEDLINE | ID: mdl-36320850
20.
Boosting Zn2+ Diffusion via Tunnel-Type Hydrogen Vanadium Bronze for High-Performance Zinc Ion Batteries.
ACS Appl Mater Interfaces
; 14(6): 7909-7916, 2022 Feb 16.
Artigo
Inglês
| MEDLINE | ID: mdl-35103464