Search Results - "Vidal, Angel"
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CO2 Complexes with Five-Membered Heterocycles: Structure, Topology, and Spectroscopic Characterization
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (30-11-2017)“…In a first step toward the rational design of macrocyclic structures optimized for CO2 capture, we systematically explored the potential of 30 five-membered…”
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Lennard-Jones Intermolecular Potentials for the Description of 6‑Membered Aromatic Heterocycles Interacting with the Isoelectronic CO2 and CS2
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (23-05-2019)“…We have generated Lennard-Jones potentials for the interaction between CX2 (X = O, S) and 11 nitrogen-doped benzene derivatives in different orientations at…”
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Lennard-Jones Potentials for the Interaction of CO2 with Five-Membered Aromatic Heterocycles
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (14-12-2017)“…We used M06-2X/Def2-TZVPP to calculate a broad set of rigid interaction profiles between CO2 and 30 different aromatic heterocycles, based on pyrrole, furan,…”
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Alkylammonium Cation Affinities of Nitrogenated Organobases: The Roles of Hydrogen Bonding and Proton Transfer
Published in ChemPlusChem (Weinheim, Germany) (01-08-2021)“…Alkylammonium cation affinities of 64 nitrogen‐containing organobases, as well as the respective proton transfer processes from the alkylammonium cations to…”
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5
Review of the Properties of GaN, InN, and Their Alloys Obtained in Cubic Phase on MgO Substrates by Plasma-Enhanced Molecular Beam Epitaxy
Published in Crystals (Basel) (01-09-2024)“…Gallium nitride (GaN) semiconductors and their broadband InGaN alloys in their hexagonal phase have been extensively studied over the past 30 years and have…”
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Recent Highlights in Ketenimine Chemistry
Published in European journal of organic chemistry (01-10-2012)“…Selected recent developments in the chemistry of ketenimines are presented, demonstrating that heterocumulenes of this class are versatile reactive…”
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Aromatic interactions of allenyl-anthracene derivatives with pi-electron acceptor molecules: an experimental and computational study
Published in Supramolecular chemistry (02-01-2020)“…Electrostatic effects play an important role in aromatic interactions towards molecular recognition. Anthraceno-allenophanes are cyclic π-conjugated aromatic…”
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Functionalization of Acetalic C(sp3)-H Bonds by Scandium(III) Triflate-Catalyzed Intramolecular Redox Reactions: Tandem 1,4-Hydride Transfer/1,5-Cyclization Processes Leading to Protected 1-Indanones
Published in Advanced synthesis & catalysis (07-03-2011)“…A new CC bond forming reaction leading to adjacent quaternary carbons is reported. It is a one‐pot hydride shift/cyclization process facilitated by the…”
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Tandem Processes in C-Aryl Ketenes and Ketenimines Triggered by [1,5]-Hydride-Like Migration of an Acetalic Hydrogen Atom
Published in European journal of organic chemistry (01-02-2014)“…Heating a range of suitably substituted diazoacetoacetates produced a family of 2‐(1,3‐dioxolan‐2‐yl)phenyl ketenes that, under thermal conditions, smoothly…”
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10
Novel Zero-Sequence Blocking Transformer (ZSBT) Using Three Single-Phase Transformers
Published in IEEE transactions on energy conversion (01-03-2013)“…Zero-sequence blocking transformers (ZSBTs), used to block the zero-sequence components that are present in a three-phase system, are commonly built winding…”
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11
Unlocking the synthetic potential of aziridine and cyclopropane-fused quinolin-2-ones by regioselective fragmentation of its three-membered rings
Published in Arabian journal of chemistry (01-01-2020)“…Aziridine- and cyclopropa-fused quinolones, obtained by annulation of the quinoline core to substituted aziridines and cyclopropanes, undergo regioselective…”
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12
A Large Power, Low-Switching-Frequency Voltage Source Converter for FACTS Applications With Low Effects on the Transmission Line
Published in IEEE transactions on power electronics (01-12-2012)“…This paper presents a novel large power voltage source converter for flexible ac transmission systems' applications that employs four three-level, three-phase…”
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Enhanced Synergistic performance of ZnO@BiOX (X=Cl, Br, I) heterojunction for photocatalytic degradation of emerging pollutants under visible light
Published in Journal of photochemistry and photobiology. A, Chemistry. (01-02-2025)“…[Display omitted] •Photocatalytic treatment of textile wastewater is a promising environmental option.•Semiconductor heterojunctions prevent significatively…”
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14
Traces identity and imaginary teens
Published in Análisi (Bellaterra, Spain) (15-12-2016)Get full text
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15
On the Use of Popular Basis Sets: Impact of the Intramolecular Basis Set Superposition Error
Published in Molecules (Basel, Switzerland) (22-10-2019)“…The magnitude of intramolecular basis set superposition error (BSSE) is revealed via computing systematic trends in molecular properties. This type of error is…”
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Unprecedented intramolecular [3 + 2] cycloadditions of azido-ketenimines and azido-carbodiimides. Synthesis of indolo[1,2-a]quinazolines and tetrazolo[5,1-b]quinazolines
Published in Organic & biomolecular chemistry (07-10-2011)“…N-(2-azidomethyl)phenyl ketenimines and N-(2-azidomethyl)phenyl-N'-alkyl(aryl) carbodiimides undergo, under mild thermal conditions, intramolecular [3 + 2]…”
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Tandem processes promoted by a hydrogen shift in 6-arylfulvenes bearing acetalic units at ortho position: a combined experimental and computational study
Published in Beilstein journal of organic chemistry (11-02-2016)“…6-Phenylfulvenes bearing (1,3-dioxolan or dioxan)-2-yl substituents at ortho position convert into mixtures of 4- and 9-(hydroxy)alkoxy-substituted…”
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Unexpected new examples of the Thyagarajan-Majumdar tandem cyclization of aryl propargyl sulfoxides
Published in ARKIVOC (12-06-2013)Get full text
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Online Reference Limitation Method of Shunt-Connected Converters to the Grid to Avoid Exceeding Voltage and Current Limits Under Unbalanced Operation-Part I: Theory
Published in IEEE transactions on energy conversion (01-09-2015)“…This paper focuses the analysis around a grid-connected converter that operates under unbalanced voltage and current conditions. Two different scenarios have…”
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Predictive Control Strategy for DC/AC Converters Based on Direct Power Control
Published in IEEE transactions on industrial electronics (1982) (01-06-2007)“…This paper proposes predictive direct power control (P-DPC), a new control approach where the well-known direct power control is combined with predictive…”
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