Browsing by Author "Roldao J.C."
Now showing 1 - 12 of 12
Results Per Page
Sort Options
Publication Accurate Calculation of Excited-State Absorption for Small-to-Medium-Sized Conjugated Oligomers: Multiconfigurational Treatment vs Quadratic Response TD-DFT(2022) Roldao J.C.; Oliveira E.F.; Milián-Medina B.; Gierschner, Johannes; Roca-Sanjuán D.; "Madrid Institute for Advanced Studies, Imdea Nanoscience, Ciudad Universitaria de Cantoblanco, C. Faraday 9, Madrid, 28049, Spain"," São Paulo State Department of Education, São Paulo, 03349-030, Brazil"," Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Av. Dr. Moliner 50, Valencia, Burjassot, 46100, Spain"," Institute of Molecular Science, University of Valencia, Paterna, 46980, Spain"; 000000041762408XPublication Boosting the Stimulated Emission Properties of Host:Guest Polymer Blends by Inserting Chain Twists in the Host Polymer(2022) Sun C.; Bai L.; Roldao J.C.; Burgos-Caminal A.; Borrell-Grueiro O.; Lin J.; Huang W.; Gierschner, Johannes; Gawelda, Wojciech; Bañares, Luis; Cabanillas González, Juan; "Madrid Institute for Advanced Studies, IMDEA Nanoscience, Ciudad Universitaria de, Cantoblanco, Calle Faraday 9, Madrid, 28049, Spain"," Key Laboratory of Flexible Electronics (KLOFE) & Institute of Advanced Materials, Jiangsu National Synergetic Innovation Center for Advanced Materials, Nanjing Tech University, 30 South Puzhu Road, Nanjing, 211816, China"," Donostia International Physics Center (DIPC), Manuel Lardizabal Ibilbidea 4, San Sebastián, 20018, Spain"," Departamento de Química, Universidad Autónoma de Madrid, Ciudad Universitaria de Cantoblanco, Calle Francisco Tomás y Valiente 7, Madrid, 28049, Spain"," Departamento de Química Física and Center for Ultrafast Lasers, Facultad de Ciencias Químicas, Universidad Complutense de Madrid, Madrid, 2804, Spain"; 000000041762408XPublication Calculation of low bandgap homopolymers: Comparison of TD-DFT methods with experimental oligomer series(2016) Oliveira E.F.; Roldao J.C.; Milián-Medina B.; Lavarda F.C.; Gierschner, Johannes; "UNESP - Univ Estadual Paulista, POSMAT - Graduate Program in Material Science and Technology, Av. Eng. Luiz Edmundo Carrijo Coube 14-01, Bauru, SP 17033-360, Brazil"," Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Avda. Dr. Moliner 50, Burjassot, Valencia, 46100, Spain"," Institute for Advanced Studies, IMDEA Nanoscience, Campus Cantoblanco, C/Faraday 9, Madrid, 28049, Spain"," DF-FC, UNESP - Univ Estadual Paulista, Av. Eng. Luiz Edmundo Carrijo Coube 14-01, Bauru, SP 17033-360, Brazil"; 000000041762408XPublication Combined Spectroscopic and TD-DFT Analysis to Elucidate Substituent and Acidochromic Effects in Organic Dyes: A Case Study on Amino- versus Nitro-Substituted 2,4-Diphenylquinolines(2020) dos Santos G.C.; Roldao J.C.; Shi J.; Milián-Medina B.; da Silva-Filho L.C.; Gierschner, Johannes; "Laboratory of Organic Synthesis and Processes (LOSP), São Paulo State University (UNESP), Department of Chemistry, School of Sciences, Bauru, São Paulo 17033-360, Brazil"," IMDEA Nanociencia, Ciudad Universitaria de Cantoblanco, C/ Faraday 9, Madrid, 28049, Spain"," Xi'an Institute of Flexible Electronics, Northwestern Polytechnical University Dongda Town, Dongxiang Street 1, Xi'an, Shaanxi 710072, China"," Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Avenida Dr. Moliner 50, Burjassot, Valencia 46100, Spain"; 000000041762408XPublication Counterion-Mediated Crossing of the Cyanine Limit in Crystals and Fluid Solution: Bond Length Alternation and Spectral Broadening Unveiled by Quantum Chemistry(2020) Eskandari M.; Roldao J.C.; Cerezo J.; Milián-Medina B.; Gierschner, Johannes; "Madrid Institute for Advanced Studies, IMDEA Nanoscience, Ciudad Universitaria de Cantoblanco, C/Faraday 9, Madrid, 28049, Spain"," Departamento de Química, Facultad de Ciencias, Universidad Autónoma de Madrid, Madrid, 28049, Spain"," Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Avenida Dr. Moliner 50, Valencia, Burjassot, 46100, Spain"," Department of Chemistry, Institute for Advanced Studies in Basic Sciences, Zanjan, 45137-66731, Iran"; 000000041762408XPublication Crossed 2D versus Slipped 1D π-Stacking in Polymorphs of Crystalline Organic Thin Films: Impact on the Electronic and Optical Response(2019) Aliaga-Gosalvez M.J.; Demitri N.; Dohr M.; Roldao J.C.; Park S.K.; Oh S.; Varghese S.; Park S.Y.; Olivier Y.; Milián-Medina B.; Resel R.; Gierschner, Johannes; "Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Avenida Dr. Moliner 50, Burjassot, Valencia 46100, Spain"," Elettra-Sincrotrone Trieste, S.S. 14 Km 163.5 in Area Science Park Basovizza, Trieste, 34149, Italy"," Institute of Solid State Physics, Graz University of Technology, Graz, 8010, Austria"," Madrid Institute for Advanced Studies, IMDEA Nanoscience, Calle Fararday 9, Campus Cantoblanco, Madrid, 28049, Spain"," Center for Supramolecular Optoelectronic Materials, Department of Materials Science and Engineering, Seoul National University, Seoul, 08826, South Korea"," Technical Research Centre, School of Applied and Interdisciplinary Sciences, Indian Association for the Cultivation of Science, Kolkata, West Bengal 700032, India"," Laboratory for Chemistry of Novel Materials, Université de Mons, Place du Parc 20, Mons, 7000, Belgium"," Theoretical and Structural Physical Chemistry Unit, Namur Institute of Structured Matter, University of Namur, Rue de Bruxelles, 61, Namur, 5000, Belgium"; 000000041762408XPublication Direct Observation of Structural Heterogeneity and Tautomerization of Single Hypericin Molecules(2021) Liu Q.; Wackenhut F.; Wang L.; Hauler O.; Roldao J.C.; Adam P.-M.; Brecht M.; Gierschner, Johannes; Meixner A.J.; Institute of Physical and Theoretical Chemistry, Eberhard Karls University Tübingen, Auf der Morgenstelle 18, Tübingen, 72076, Germany, Laboratoire Lumière, Nanomatériaux and Nanotechnologies - L2n, CNRS ERL 7004, Universitéde Technologie de Troyes, Troyes, 10000, France, Reutlingen Research Institute, Process Analysis and Technology (PAandT), Reutlingen University, Alteburgstraße 150, Reutlingen, 72762, Germany, Madrid Institute for Advanced Studies, IMDEA Nanoscience, Ciudad Universitaria de Cantoblanco, C/Faraday 9, Madrid, 28049, Spain; 000000041762408XPublication Highly Efficient Photocatalytic Hydrogen Evolution Using a Self-Assembled Octupolar Molecular System(2022) Lee H.-J.; Abudulimu A.; Roldao J.C.; Nam H.; Gierschner, Johannes; Lüer L.; Park S.Y.; "Center for Supramolecular Optoelectronic Materials Department of Materials Science and Engineering, Seoul National University, Seoul, 151–742, South Korea"," Madrid Institute for Advanced Studies IMDEA Nanoscience, C/ Faraday 9, Ciudad Universitaria de Cantoblanco, Madrid, 28049, Spain"," Current Address: Wright Center for Photovoltaics Innovation and Commercialization (PVIC) Department of Physics and Astronomy, The University of Toledo, Toledo, OH 43606, United States"," Current Address: Donostia International Physics Center, DIPC, Donostia, Euskadi, 20018, Spain"," Current Address: Institute of Materials for Electronics and Energy Technology (i-MEET), Friedrich-Alexander-Universität Erlangen-Nürnberg, Martensstrasse 7, Erlangen, 91058, Germany"," Research Institute of Advanced Materials (RIAM), Seoul National University, Seoul, 08826, South Korea"; 000000041762408XPublication Pure Boric Acid Does Not Show Room-Temperature Phosphorescence (RTP)(2022) Wu Z.; Roldao J.C.; Rauch F.; Friedrich A.; Ferger M.; Würthner F.; Gierschner, Johannes; Marder T.B.; "Institut für Anorganische Chemie and Institute for Sustainable Chemistry & Catalysis with Boron, Julius-Maximilians-Universität Würzburg, Am Hubland, Würzburg, 97074, Germany"," Madrid Institute for Advanced Studies, IMDEA Nanoscience, Calle Faraday 9, Campus Cantoblano, Madrid, 28049, Spain"," Institut für Organische Chemie and Center for Nanosystems Chemistry, Julius-Maximilians-Universität Würzburg, Am Hubland, Würzburg, 97074, Germany"; 000000041762408XPublication Quantum-chemistry study of the ground and excited state absorption of distyrylbenzene: Multi vs single reference methods(2022) Roldao J.C.; Oliveira E.F.; Milián-Medina B.; Gierschner, Johannes; Roca-Sanjuán D.; "Madrid Institute for Advanced Studies, IMDEA Nanoscience, Ciudad Universitaria de Cantoblanco, C. Faraday 9, Madrid, 28049, Spain"," Gleb Wataghin Institute of Physics, University of Campinas (UNICAMP), SP, Campinas, Brazil"," Center for Computational Engineering and Sciences (CCES), State University of Campinas (UNICAMP), SP, Campinas, Brazil"," Department for Physical Chemistry, Faculty of Chemistry, University of Valencia, Av. Dr. Moliner 50, Burjassot, Valencia, 46100, Spain"," Institute of Molecular Science, University of Valencia, Paterna, 46980, Spain"; 000000041762408XPublication Synthesis of solvent-free acrylic pressure-sensitive adhesives: Via visible-light-driven photocatalytic radical polymerization without additives(2020) Back J.-H.; Kwon Y.; Roldao J.C.; Yu Y.; Kim H.-J.; Gierschner, Johannes; Lee W.; Kwon M.S.; "Center for Advanced Specialty Chemicals, Korea Research Institute of Chemical Technology, Ulsan, 44412, South Korea"," Department of Materials Science and Engineering, Seoul National University, Seoul, 00826, South Korea"," Department of Materials Science and Engineering, Ulsan National Institute of Science and Technology (UNIST), Ulsan, 689-798, South Korea"," Madrid Institute for Advanced Studies, IMDEA Nanoscience Calle Faraday, 9 Campus Cantoblanco, Madrid, 28049, Spain"," Research Institute of Agriculture and Life Sciences, College of Agriculture and Life Sciences, Seoul National University, Seoul, 08826, South Korea"; 000000041762408XPublication Unraveling the Origin of High-Efficiency Photoluminescence in Mixed-Stack Isostructural Crystals of Organic Charge-Transfer Complex: Fine-Tuning of Isometric Donor-Acceptor Pairs(2020) Oh S.; Park S.K.; Jhun B.H.; Roldao J.C.; Kim J.H.; Choi M.-W.; Ryoo C.H.; Jung S.; Demitri N.; Fischer R.; Serdiuk I.E.; Resel R.; Gierschner, Johannes; Park S.Y.; "Center for Supramolecular Optoelectronic Materials, Department of Materials Science and Engineering, Seoul National University, Gwanak-gu Seoul, 151-742, South Korea"," Madrid Institute for Advanced Studies, Imdea Nanoscience, Madrid, 28805, Spain"," Elettra-Sincrotrone Trieste, S.S. 14 Km 163.5 in Area Science Park, Basovizza Trieste, 34149, Italy"," Institute of Inorganic Chemistry, Graz University of Technology, Graz, 8010, Austria"," Faculty of Mathematics, Physics and Informatics, University of Gda?sk, Wita Stwosza 57, Gda?sk, 80-308, Poland"," Institute of Solid State Physics, Graz University of Technology, Graz, 8010, Austria"; 000000041762408X