R. Viruela

发表

Difficulties of density functional theory in predicting the torsional potential of 2,2′-bithiophene

E. Ortí, P. Viruela, R. Viruela, 1998 .

Discrete supramolecular donor-acceptor complexes.

E. Ortí, D. Guldi, L. Sánchez, 2009, Angewandte Chemie.

Electronic spectra of tetrathiafulvalene and its radical cation: analysis of the performance of the time-dependent DFT approach

E. Ortí, P. Viruela, R. Viruela, 2002 .

Aminopyrimidine‐Based Donor–Acceptor Chromophores: Push–Pull versus Aromatic Behaviour

E. Ortí, M. Herranz, N. Martín, 2008 .

Valence bands of poly(methylmethacrylate) and photoion emission in vacuum ultraviolet region

Y. Kobayashi, E. Ortí, H. Ikeura, 1992 .

Bowl-shape electron donors with absorptions in the visible range of the solar spectrum and their supramolecular assemblies with C60

E. Ortí, D. Guldi, Bruno Grimm, 2012 .

SYNTHESIS AND ELECTROCHEMISTRY OF ELECTRONEGATIVE SPIROANNELATED METHANOFULLERENES : THEORETICAL UNDERPINNING OF THE ELECTRONIC EFFECT OF ADDENDS AND A REDUCTIVE CYCLOPROPANE RING-OPENING REACTION

C. Rovira, J. Veciana, J. Vidal-Gancedo, 1997 .

Relationship between Electron Affinity and Half-Wave Reduction Potential: A Theoretical Study on Cyclic Electron-Acceptor Compounds.

E. Ortí, J. Calbo, J. Aragó, 2016, Chemphyschem : a European journal of chemical physics and physical chemistry.

Theoretical insights into the structural, electronic and optical properties of benzotrithiophene-based hole-transporting materials

E. Ortí, J. Calbo, J. Aragó, 2017, Theoretical Chemistry Accounts.

Synthesis, Properties, and Theoretical Characterization of Largely π-Extended Tetrathiafulvalene Derivatives with Quinonoid Structures

E. Ortí, L. Sánchez, N. Martín, 1998 .

A theoretical study of neutral and reduced tetracyano-p-quinodimethane (TCNQ)

E. Ortí, R. Viruela, R. Pou-Amérigo, 2004 .

Efficient light harvesters based on the 10-(1,3-dithiol-2-ylidene)anthracene core.

E. Ortí, N. Martín, J. L. Delgado, 2013, Organic letters.

The Role of Planarity versus Nonplanarity in the Electronic Communication of TCAQ-Based Push-Pull Chromophores.

E. Ortí, M. Herranz, N. Martín, 2018, ChemPlusChem.

Theoretical description of the Raman spectrum of a vinylene-bridged quaterthiophene oligomer

E. Ortí, J. Navarrete, J. Casado, 2003 .

Synthesis, properties and charge transfer complexes of covalently attached [60]fullerene-tetrathiafulvalenes

J. Orduna, E. Ortí, L. Sánchez, 1997 .

Concave tetrathiafulvalene-type donors as supramolecular partners for fullerenes.

E. Ortí, L. Sánchez, N. Martín, 2007, Angewandte Chemie.

A fully conjugated TTF-π-TCAQ system: synthesis, structure, and electronic properties.

E. Ortí, D. Guldi, N. Martín, 2011, Chemistry.

A bis-exTTF macrocyclic receptor that associates C60 with micromolar affinity.

E. Ortí, N. Martín, E. Pérez, 2010, Journal of the American Chemical Society.

Donor–π‐Acceptor Species Derived from Functionalised 1,3‐Dithiol‐2‐ylidene Anthracene Donor Units Exhibiting Photoinduced Electron Transfer Properties: Spectroscopic, Electrochemical, X‐Ray Crystallographic and Theoretical Studies

I. Lednev, R. Hester, E. Ortí, 1998 .

A bis(triazole)benzamide receptor for the complexation of halide anions and neutral carboxylic acid guests. Guest-controlled topicity and self-assembly.

E. Ortí, L. Sánchez, Fátima García, 2013, Organic & biomolecular chemistry.

Single-Component Donor-Acceptor Organic Semiconductors Derived from TCNQ

E. Ortí, J. Segura, N. Martín, 1994 .

Effects of Carbon-sp3 Bridging on the Electronic Properties of Oligothiophenes

E. Ortí, M. Sanchis, P. Viruela, 1999 .

A new series of π-extended tetrathiafulvalene derivatives incorporating fused furanodithiino and thienodithiino units: a joint experimental and theoretical study

E. Ortí, S. Coles, M. Hursthouse, 2004 .

A New Type of π-Electron Donors with One Dithiole Unit: Substituted 7-(1,3-Dithiol-2-ylidene)-7-hydrobenz[d,e]anthracenes

E. Ortí, L. Sánchez, N. Martín, 1999 .

The First sulfur‐containing twin‐DCNQI‐type acceptor

E. Ortí, J. Segura, N. Martín, 1994 .

Experimental and theoretical studies into the structural perturbations between neutral, oxidised and reduced forms of 1,4-dithiinoquinoxaline derivatives

E. Ortí, J. Howard, L. Goldenberg, 2000 .

REACTION OF C60 WITH SULTINES: SYNTHESIS, ELECTROCHEMISTRY, AND THEORETICAL CALCULATIONS OF ORGANOFULLERENE ACCEPTORS

E. Ortí, Andreas Martin, B. Illescas, 1997 .

Weighting non-covalent forces in the molecular recognition of C(60). Relevance of concave-convex complementarity.

E. Ortí, L. Sánchez, N. Martín, 2008, Chemical communications.

Flexibility of TTF. a theoretical study

E. Ortí, P. Viruela, R. Viruela, 1999 .

π Conjugation Across the Tetrathiafulvalene Core: Synthesis of Extended Tetrathiafulvalene Derivatives and Theoretical Analysis of their Unusual Electrochemical Properties

Bouchta Sahraoui, Enrique Ortí, Marc Sallé, 2000 .

Synthesis and radical coupling of pyridine-bridged pi-extended tetrathiafulvalene (TTF)-type donors and push-pull analogues.

E. Ortí, L. Sánchez, N. Martín, 2007, Organic & biomolecular chemistry.

BENZOANNULATED QUINONE-TYPE ELECTRON ACCEPTORS : EVOLUTION OF THE MOLECULAR AND ELECTRONIC STRUCTURES UPON REDUCTION

E. Ortí, P. Viruela, R. Viruela, 1998 .

First signals of electrochemically oxidized species of TTF and TTM-TTF: A study by in situ spectroelectrochemical FTIR and DFT calculations

E. Ortí, M. Sallé, E. Levillain, 2003 .

New functionalized tetrathiafulvalenes: X-ray crystal structures and physico-chemical properties of TTF–C(O)NMe2 and TTF–C(O)–O–C4H9: a joint experimental and theoretical study

E. Ortí, J. Howard, A. Moore, 1995 .

6,11-Bis(dicyanomethylene)-12-methylbenzo[b]phenoxazine and 6,11-dicyanimino-12-methylbenzo[b]phenoxazine as novel donor–acceptor systems

E. Ortí, J. Segura, N. Martín, 1995 .

Electronic interactions in a new pi-extended tetrathiafulvalene dimer.

E. Ortí, E. Levillain, I. F. Perepichka, 2006, Chemistry.

The interplay of inverted redox potentials and aromaticity in the oxidized states of new pi-electron donors: 9-(1,3-dithiol-2-ylidene)fluorene and 9-(1,3-dithiol-2-ylidene)thioxanthene derivatives.

C. Rovira, J. Vidal-Gancedo, E. Ortí, 2006, Chemistry.

New 1,3-dithiol-2-ylidene donor–π–acceptor chromophores with intramolecular charge-transfer properties, and related donor–π–donor molecules: synthesis, electrochemistry, X-ray crystal structures, non-linear optical properties and theoretical calculations

E. Ortí, J. Howard, A. Moore, 1998 .

Theoretical study of the molecular structure and the stability of neutral and reduced tetracyanoethylene

E. Ortí, R. Viruela, R. Pou-Amérigo, 2003 .

Molecular orbital calculation of the soft-hard acidity of zeolites and its catalytic implications

A. Corma, C. Zicovich-Wilson, G. Sastre, 1992 .

On the electron affinity of TCNQ

E. Ortí, R. Viruela, R. Pou-Amérigo, 2004 .

Influence of nitrogen substitution on the electronic band structure of poly(peri-naphthalene)

E. Ortí, P. Viruela, R. Viruela, 1994 .

Donor-π-acceptors containing the 10-(1,3-dithiol-2-ylidene)anthracene unit for dye-sensitized solar cells.

S. Zakeeruddin, M. Grätzel, R. Humphry-Baker, 2012, Chemistry.

Highly conjugated p-quinonoid pi-extended tetrathiafulvalene derivatives: a class of highly distorted electron donors.

E. Ortí, D. Guldi, N. Martín, 2004, Chemistry.

A theoretical study of the molecular and electronic structure of benzoannulated tetracyanoquinodimethanes

E. Ortí, P. Viruela, R. Viruela, 1995 .

Synthesis, Characterization, and Theoretical Study of Sulfur-Containing Donor-Acceptor DCNQI Derivatives with Photoinduced Intramolecular Electron Transfer.

C. Rovira, J. Veciana, J. Vidal-Gancedo, 1996, The Journal of organic chemistry.

SYNTHESIS AND CHARACTERIZATION A NOVEL DONOR-ACCEPTOR NAPHTHOQUINONE DERIVATIVES WITH PHOTOINDUCED CHARGE-TRANSFER PROPERTIES. A JOINT EXPERIMENTAL AN D THEORETICAL STUDY

E. Ortí, J. Segura, N. Martín, 1995 .

Geometric Structure and Torsional Potential of Biisothianaphthene. A Comparative DFT and ab Initio Study

J. Brédas, P. Viruela, R. Viruela, 1997 .

Molecular and electronic structure of a largely extended tetracyanoquinodimethane

E. Ortí, N. Martín, P. Viruela, 1995 .