Detalles de la búsqueda
1.
Self-Consistent Quantum Mechanics/Embedded Charge Study on Aggregation-Enhanced Delayed Fluorescence of Cu(I) Complexes: Luminescence Mechanism and Molecular Design Strategy.
Inorg Chem
; 62(20): 7753-7763, 2023 May 22.
Artículo
en Inglés
| MEDLINE | ID: mdl-37154416
2.
Molecular Design of Highly Efficient Heavy-Atom-free NpImidazole Derivatives for Two-Photon Photodynamic Therapy and ClO- Detection.
J Chem Inf Model
; 63(14): 4392-4404, 2023 07 24.
Artículo
en Inglés
| MEDLINE | ID: mdl-37418660
3.
Theoretical study of the tuning role of ß-methylthio or ß-methylselenyl on the charge-transport properties of acenedithiophenes derivatives.
Phys Chem Chem Phys
; 25(15): 10313-10324, 2023 Apr 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-36987913
4.
Photophysical Exploration of Zn(II) Polypyridine Photosensitizers in Two-Photon Photodynamic Therapy: Insights from Theory.
Inorg Chem
; 61(46): 18729-18742, 2022 Nov 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-36351263
5.
From luminescence quenching to high-efficiency phosphorescence: a theoretical study on the monomeric and dimeric forms of platinum(II) complexes with both 2-pyridylimidazol-2-ylidene and bipyrazolate chelates.
Phys Chem Chem Phys
; 23(9): 5652-5664, 2021 Mar 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-33656501
6.
Molecular-Level Insight of Cu(I) Complexes with the 7,8-Bis(diphenylphosphino)-7,8-dicarba-nido-undecaborate Ligand as a Thermally Activated Delayed Fluorescence Emitter: Luminescent Mechanism and Design Strategy.
Inorg Chem
; 59(17): 12039-12053, 2020 Sep 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-32786269
7.
Theoretical Investigations into the Electron and Ambipolar Transport Properties of Anthracene-Based Derivatives.
J Phys Chem A
; 123(15): 3300-3314, 2019 Apr 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-30900901
8.
Are triphenylamine-functionalized or carbazole-functionalized iridium complexes the more effective phosphorescent materials? A theoretical perspective.
Chemistry
; 20(16): 4671-80, 2014 Apr 14.
Artículo
en Inglés
| MEDLINE | ID: mdl-24596028
9.
In-depth theoretical analysis of the influence of an external electric field on charge transport parameters.
Chem Sci
; 15(12): 4403-4415, 2024 Mar 20.
Artículo
en Inglés
| MEDLINE | ID: mdl-38516067
10.
Computational design of two-photon fluorescent probes for a zinc ion based on a Salen ligand.
Inorg Chem
; 52(10): 5702-13, 2013 May 20.
Artículo
en Inglés
| MEDLINE | ID: mdl-23654211
11.
A Theoretical Investigation into the Homo- and Hetero-leptic Cu(I) Phosphorescent Complexes Bearing 2,9-dimethyl-1,10-phenanthroline and bis [2-(diphenylphosphino)phenyl]ether Ligand.
Materials (Basel)
; 15(20)2022 Oct 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-36295319
12.
How dual bridging atoms tune structural and optoelectronic properties of ladder-type heterotetracenes?--a theoretical study.
Phys Chem Chem Phys
; 13(43): 19490-8, 2011 Nov 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-21976209
13.
Visualization and quantification of cadmium accumulation, chelation and antioxidation during the process of vacuolar compartmentalization in the hyperaccumulator plant Solanum nigrum L.
Plant Sci
; 310: 110961, 2021 Sep.
Artículo
en Inglés
| MEDLINE | ID: mdl-34315586
14.
Impact of ΔEST on Delayed Fluorescence Rate, Lifetime, and Intensity Ratio of Tetrahedral Cu(I) Complexes: Theoretical Simulation in Solution and Solid Phases.
J Phys Chem Lett
; 12(9): 2232-2244, 2021 Mar 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-33635675
15.
A time-dependent density functional theory investigation on the origin of red chemiluminescence.
Chemphyschem
; 11(1): 251-9, 2010 Jan 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-19937903
16.
Theoretical investigation on the origin of yellow-green firefly bioluminescence by time-dependent density functional theory.
Chemphyschem
; 11(10): 2199-204, 2010 Jul 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-20480487
17.
Theoretical study on photophysical properties of ambipolar spirobifluorene derivatives as efficient blue-light-emitting materials.
J Phys Chem A
; 113(27): 7933-9, 2009 Jul 09.
Artículo
en Inglés
| MEDLINE | ID: mdl-19507831
18.
[Effects of elevated atmospheric CO2 concentration on chemical composition of rice straw]. / 大æ°CO2æµåº¦åé«å¯¹æ°´ç¨»ç§¸ç§åå¦ç»æçå½±å.
Ying Yong Sheng Tai Xue Bao
; 30(8): 2717-2724, 2019 Aug.
Artículo
en Zh
| MEDLINE | ID: mdl-31418197
19.
Theoretical study on structural, electronic, and optical properties of ambipolar diphenylamino end-capped oligofluorenylthiophenes and fluoroarene-thiophene as light-emitting materials.
J Phys Chem A
; 112(43): 10904-11, 2008 Oct 30.
Artículo
en Inglés
| MEDLINE | ID: mdl-18834103
20.
Theoretical study on photophysical properties of multifunctional electroluminescent molecules with different pi-conjugated bridges.
J Phys Chem A
; 112(47): 12172-8, 2008 Nov 27.
Artículo
en Inglés
| MEDLINE | ID: mdl-18959398