Detalhe da pesquisa
1.
Nanoscale Investigation of Local Thermal Expansion at SrTiO3 Grain Boundaries by Electron Energy Loss Spectroscopy.
Nano Lett
; 21(24): 10416-10422, 2021 Dec 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-34854692
2.
Quantum Deep Field: Data-Driven Wave Function, Electron Density Generation, and Atomization Energy Prediction and Extrapolation with Machine Learning.
Phys Rev Lett
; 125(20): 206401, 2020 Nov 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-33258648
3.
Searching the stable segregation configuration at the grain boundary by a Monte Carlo tree search.
J Chem Phys
; 148(24): 241741, 2018 Jun 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-29960339
4.
Assessment of Strain-Generated Oxygen Vacancies Using SrTiO3 Bicrystals.
Nano Lett
; 15(6): 4129-34, 2015 Jun 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-26000901
5.
Unraveling the Stability of Layered Intercalation Compounds through First-Principles Calculations: Establishing a Linear Free Energy Relationship with Aqueous Ions.
ACS Phys Chem Au
; 4(3): 281-291, 2024 May 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-38800725
6.
Microscopic chemical characterization of epoxy resin with scanning transmission electron microscopy - electron energy-loss spectroscopy.
Micron
; 180: 103623, 2024 May.
Artigo
em Inglês
| MEDLINE | ID: mdl-38461563
7.
Combinatorial characterization of metastable luminous silver cations.
Sci Rep
; 14(1): 4638, 2024 Feb 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-38409370
8.
Full automation of point defect detection in transition metal dichalcogenides through a dual mode deep learning algorithm.
Mater Horiz
; 11(3): 747-757, 2024 Feb 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-37990857
9.
Effect of inorganic material surface chemistry on structures and fracture behaviours of epoxy resin.
Nat Commun
; 15(1): 1898, 2024 Mar 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-38459006
10.
Atomistic Probing of Defect-Engineered 2H-MoTe2 Monolayers.
ACS Nano
; 18(9): 6927-6935, 2024 Mar 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-38374663
11.
Prediction of the Ground-State Electronic Structure from Core-Loss Spectra of Organic Molecules by Machine Learning.
J Phys Chem Lett
; 14(20): 4858-4865, 2023 May 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-37199249
12.
A lithium superionic conductor for millimeter-thick battery electrode.
Science
; 381(6653): 50-53, 2023 Jul 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-37410839
13.
Simulated carbon K edge spectral database of organic molecules.
Sci Data
; 9(1): 214, 2022 May 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-35577821
14.
Atomic structure of a CeO2 grain boundary: the role of oxygen vacancies.
Nano Lett
; 10(11): 4668-72, 2010 Nov 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-20977250
15.
Quantum Deep Descriptor: Physically Informed Transfer Learning from Small Molecules to Polymers.
J Chem Theory Comput
; 17(12): 7814-7821, 2021 Dec 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-34846893
16.
Automatic determination of the spectrum-structure relationship by tree structure-based unsupervised and supervised learning.
Ultramicroscopy
; 233: 113438, 2021 Dec 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-34915289
17.
Dataset on structure and physical properties of stable diatomic systems based on van der Waals density functional method.
Data Brief
; 36: 106968, 2021 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-33869695
18.
Robotic fabrication of high-quality lamellae for aberration-corrected transmission electron microscopy.
Sci Rep
; 11(1): 21599, 2021 11 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-34732755
19.
Origins of hole doping and relevant optoelectronic properties of wide gap p-type semiconductor, LaCuOSe.
J Am Chem Soc
; 132(42): 15060-7, 2010 Oct 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-20925406
20.
Machine learning approaches for ELNES/XANES.
Microscopy (Oxf)
; 69(2): 92-109, 2020 Apr 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-31993623