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SERS mapping in langmuir-blodgett films and single-molecule detection
(2013-05-01)
Plasmon-enhanced spectroscopic techniques have expanded single-molecule detection (SMD) and are revolutionizing areas such as bio-imaging and single-cell manipulation. Surface-enhanced (resonance) Raman scattering (SERS ...
Electron localization function as a measure of electron delocalization and aromaticity
(2011)
The Electron Localization Function (ELF) has played in the last time an important role in understanding the special characteristics of the chemical bond. The chemical interpretation of the ELF as an indicator of the regions ...
Sulfur Radicals as Tethers for the Adsorption of Aromatic Molecules on Silicon Surface
(AMER SCIENTIFIC PUBLISHERSVALENCIA, 2012)
In this work we employ the state of the art pseudopotential method, within a generalized gradient approximation to the density functional theory, to investigate the adsorption process of benzenethiol and diphenyl disulfide ...
Electronic indices from semi-empirical calculations to identify carcinogenic activity of polycyclic aromatic hydrocarbons
(Elsevier Science BvAmsterdamHolanda, 2000)
Aromatic molecules as spintronic devices
(AMERICAN INSTITUTE OF PHYSICS, 2014)
Aromatic molecules as spintronic devices
(AMERICAN INSTITUTE OF PHYSICS, 2014)
Quantum transport through aromatic molecules
(AMER INST PHYSICS, 2013)
Quantum transport through aromatic molecules
(AMER INST PHYSICS, 2013)
Insights into the role of D-A-π-A type pro-aromatic organic dyes with thieno[3,4-b]pyrazine as A acceptor group into dye-sensitized solar-cells. A TD-DFT/periodic DFT study
(Wiley, 2020)
Time-dependent density functional theory (TD-DFT)/periodic DFT calculations were performed to determine the role of pro-aromatic organic D-A-pi-A type dyes (the NL1-NL17 family) with Thieno[3,4-b]pyrazine (Tpy) as A acceptor ...
Photodynamic action of methylene blue subjected to aromatic aromatic interactions with poly(sodium 4-styrenesulfonate) in solution and supported in solid, highly porous alginate sponges
(2017)
Here, we highlight the potential of aromatic charged polymer/dye complexes as candidates to integer new functional formulations and materials with specific characteristics given by complexation through aromatic-aromatic ...