Detalhe da pesquisa
1.
Uranyl Affinity between Uranyl Cation and Different Kinds of Monovalent Anions: Density Functional Theory and Quantitative Structure-Property Relationship Model.
J Phys Chem A;
128(15): 2960-2970, 2024 Apr 18.
Artigo
em Inglês
| MEDLINE
| ID: mdl-38576211
2.
Ion transport through short nanopores modulated by charged exterior surfaces.
J Chem Phys;
160(7)2024 Feb 21.
Artigo
em Inglês
| MEDLINE
| ID: mdl-38363999
3.
Computational analysis of non-heme iron-oxo formation by direct NO release in nitrite reduction.
Phys Chem Chem Phys;
21(12): 6643-6650, 2019 Mar 28.
Artigo
em Inglês
| MEDLINE
| ID: mdl-30855607
4.
A highly hydrolytically stable lanthanide organic framework as a sensitive luminescent probe for DBP and chlorpyrifos detection.
Analyst;
143(22): 5481-5486, 2018 Nov 05.
Artigo
em Inglês
| MEDLINE
| ID: mdl-30289144
5.
Two-Dimensional Deep-Ultraviolet Beryllium-Free KBe2BO3F2 Family Nonlinear-Optical Monolayer.
Inorg Chem;
57(13): 7503-7506, 2018 Jul 02.
Artigo
em Inglês
| MEDLINE
| ID: mdl-29882659
6.
Theoretical perspectives on the structure, electronic, and optical properties of titanosilicates Li2M4[(TiO)Si4O12] (M = K+, Rb+).
Phys Chem Chem Phys;
19(23): 15120-15128, 2017 Jun 14.
Artigo
em Inglês
| MEDLINE
| ID: mdl-28569905
7.
Interfacial electronic structure and charge transfer of hybrid graphene quantum dot and graphitic carbon nitride nanocomposites: insights into high efficiency for photocatalytic solar water splitting.
Phys Chem Chem Phys;
18(2): 1050-8, 2016 Jan 14.
Artigo
em Inglês
| MEDLINE
| ID: mdl-26659558
8.
Carbon monoxide oxidation catalysed by defective palladium chloride: DFT calculations, EXAFS, and in situ DRIRS measurements.
Phys Chem Chem Phys;
18(4): 2784-91, 2016 Jan 28.
Artigo
em Inglês
| MEDLINE
| ID: mdl-26725777
9.
Anisotropic thermoelectric properties of layered compounds in SnX2 (X = S, Se): a promising thermoelectric material.
Phys Chem Chem Phys;
17(44): 29844-53, 2015 Nov 28.
Artigo
em Inglês
| MEDLINE
| ID: mdl-26486877
10.
A novel Pd3O9@α-Al2O3 catalyst under a hydroxylated effect: high activity in the CO oxidation reaction.
Phys Chem Chem Phys;
17(48): 32140-8, 2015 Dec 28.
Artigo
em Inglês
| MEDLINE
| ID: mdl-26308732
11.
Insights into the reaction mechanism of CO oxidative coupling to dimethyl oxalate over palladium: a combined DFT and IR study.
Phys Chem Chem Phys;
17(14): 9126-34, 2015 Apr 14.
Artigo
em Inglês
| MEDLINE
| ID: mdl-25759866
12.
Exploring Second-Order Nonlinear Optical Properties and Switching Ability of a Series of Dithienylethene-Containing, Cyclometalated Platinum Complexes: A Theoretical Investigation.
J Phys Chem A;
119(29): 8174-81, 2015 Jul 23.
Artigo
em Inglês
| MEDLINE
| ID: mdl-26107466
13.
Evaluation of interactions between urokinase plasminogen and inhibitors using molecular dynamic simulation and free-energy calculation.
J Phys Chem A;
118(39): 9113-9, 2014 Oct 02.
Artigo
em Inglês
| MEDLINE
| ID: mdl-24984238
14.
Colorimetric method transforms into highly sensitive homogeneous voltammetric sensing strategy for mercury ion based on mercury-stimulated Ti3C2Tx MXene nanoribbons@gold nanozyme activity.
Anal Chim Acta;
1250: 340975, 2023 Apr 15.
Artigo
em Inglês
| MEDLINE
| ID: mdl-36898821
15.
Nitrogen-doped Ti3C2 MXene quantum dots as an effective FRET ratio fluorometric probe for sensitive detection of Cu2+ and D-PA.
Spectrochim Acta A Mol Biomol Spectrosc;
293: 122484, 2023 May 15.
Artigo
em Inglês
| MEDLINE
| ID: mdl-36796242
16.
Iodine-doped g-C3N4 modified zinc titanate electron transporting layer for highly efficient perovskite solar cells.
J Colloid Interface Sci;
635: 159-166, 2023 Apr.
Artigo
em Inglês
| MEDLINE
| ID: mdl-36584616
17.
Upon DFT-D3 dispersion correction and ECD spectral confirmation, only several conformers can stably coexist for three fungal cycloaspeptides (A, D, G).
Spectrochim Acta A Mol Biomol Spectrosc;
283: 121710, 2022 Dec 15.
Artigo
em Inglês
| MEDLINE
| ID: mdl-35952587
18.
Robust Mesoporous Functional Hydrogen-Bonded Organic Framework for Hypochlorite Detection.
ACS Appl Mater Interfaces;
14(18): 21098-21105, 2022 May 11.
Artigo
em Inglês
| MEDLINE
| ID: mdl-35482947
19.
Cuttlefish ink loaded polyamidoxime adsorbent with excellent photothermal conversion and antibacterial activity for highly efficient uranium capture from natural seawater.
J Hazard Mater;
433: 128789, 2022 07 05.
Artigo
em Inglês
| MEDLINE
| ID: mdl-35358815
20.
In situ synthesis of g-C3N4 by glass-assisted annealing route to boost the efficiency of perovskite solar cells.
J Colloid Interface Sci;
591: 326-333, 2021 Jun.
Artigo
em Inglês
| MEDLINE
| ID: mdl-33621784