Conference: XXXIV XRQTC Annual Meeting. Barcelona (ESP) 2018. Title: XXXIV XRQTC Annual Meeting, Barcelona Author: A. Poater Conference: International Conference on Mathematical Modeling in Pysical Sciences. Madrid (ESP) 2014. Title: Author: A. Poater Conference: Polymers in Nanotechnology. Salerno (ESP) 2007. Title: Author: A. Poater Conference: XXIII Reunió de la Xarxa de Química Teòrica de Catalunya. Tarragona (ESP) 2007. Title: Author: A. Poater Conference: XXII Reunió de la Xarxa de Química Teòrica. Barcelona (ESP) 2006. Title: Author: A. Poater Conference: VII Girona Seminar: on the nature of the chemical bond. Girona (ESP) 2006. Title: Author: A. Poater Conference: XXI Reunió de la Xarxa de Química Teòrica de Catalunya. Bellaterra, Barcelona (ESP) 2005. Title: Author: A. Poater
Conference: 243rd ECS Meeting. Boston (USA) 2023. Title: From (Sub)Porphyrin to (Sub)Phthalocyanine: Aromaticity Signatures in the UV-Vis Absorption Spectra Author: Escayola, S.; Labella, J.; Szczepanik, D. W.; Poater, A.; Solà, M.; Torres, T.; Matito, E. Conference: 29th Canadian Symposium on Theoretical and Computational Chemistry (29th CSTCC). (CAN) 2022. Title: Predictive catalysis, calculations before experiments Author: A. Poater, S. Posada-Pérez, M. Tomasini, A. Vidal, N. Joly Conference: 12th Triennial Congress of the World Association of Theoretical and Computational Chemists. Vancouver (CAN) 2022. Title: Predictive catalysis: how to get rid of harmful gases by DFT Author: A. Poater Conference: IQCC Challenges #4. (ESP) 2022. Title: Synthesis of nitrogenated polycyclic compounds through carbene-alkyne metathesis cascades Author: Àlex Díaz-Jiménez; Roger Monreal-Corona; Miquel Solà; Albert Poater; Anna Roglans; Anna Pla-Quintana Conference: IQCC Forum. (ESP) 2021. Title: Olefin metathesis under computational evaluation Author: Artur Brotons-Rufes, Albert Poater Conference: CCE-2020: 4th International Conference on Catalysis and Chemical Engineering. Los Angeles (USA) 2020. Title: The generation of H2 vs hydrogenation of substrates: on the way to green chemistry Author: A. Poater Conference: 3rd International Conference on Catalysis and Chemical Engineering. Houston (USA) 2019. Title: Pincer Metal Catalysts for Green Chemistry Author: Albert Poater Conference: 2nd Green Chemistry & Sustainable Conference. Zurich (CHE) 2019. Title: Hydrogenation complementing the generation of H2: On the way to green chemistry Author: Albert Poater Conference: ISOM XXIII: International Symposium on Olefin Metathesis and Related Chemistry. Barcelona (ESP) 2019. Title: Predictive catalysis in olefin metathesis Author: Albert Poater Conference: 3rd Molecules and Materials for Artificial Photosynthesis Conference. Cancun (MEX) 2018. Title: How the O-O bond formation takes place in homogeneous WOC" (invited talk); Author: A. Poater Conference: 4th EMN Meeting on Computation and Theory. San Sebastian (ESP) 2018. Title: Pincer Metal Catalysts for Green Chemistry Author: A. Poater, J. A. Luque-Urrutia Conference: EMN Meeting on Catalysis. Dubrovnik (CRO) 2017. Title: Dual Metal Catalysts vs the Traditional Monometal catalysis Author: A. Poater, E. Casals, P. Besalú, J. A. Luque-Urrutia, O. Belman Conference: 2nd Molecules and Materials for Artificial Photosynthesis Conference (Fusion Conferences). Cancún (MEX) 2016. Title: Mechanistic insight of the O-O bond formation during WOC by iridium complexes Author: A. Poater Conference: 21st International Symposium on Olefin Metathesis and Related Chemistry (ISOM XXI). Graz (AUT) 2015. Title: Playing with the Relative Stability of Olefin Metathesis Catalysts Author: A. Poater Conference: The International Conference on Catalysis (ICC 2014). pekin (CHN) 2014. Title: Computational hints in olefin metathesis Author: A. Poater Conference: Methods and Applications of Computational Chemistry, (MACC-5). Kharkiv (UCR) 2013. Title: Computational Insights in Olefin Metathesis Author: Poater, A.; Solà, M.; Cavallo, L. Conference: 244th ACS National Meeting. Filadèlfia (USA) 2012. Title: Computational mechanistic insights of Ru-NHC olefin metathesis catalysts Author: A. Poater, L. Cavallo Conference: VIII Girona Seminar on Aromaticity: Basics and Applications. Girona (ESP) 2008. Title: The Mechanism of the Double C-H (De)Activation Route of a Ru-based Olefin Metathesis Catalysis Author: A. Poater, L. Cavallo Conference: 8th FIGIPAS Meeting in Inorganic Chemistry. Atenes (GRC) 2005. Title: Cooperative effects in O2-activation at dinuclear Copper complexes Author: Company, A.; Lamata, D.; Fernández-Vallejo, O.; Ribas, X.; Fontrodona, X.; Costas, M.; Poater, A.; Solà, M.; Llobet, A.; Parella, T.; Benet-Buchholz, J. Conference: 207th Meeting of the Electrochemical Society (ECS). Québec (CAN) 2005. Title: New Aspect on the Regioselective Intramolecular Pauson-Khand Reaction on [60]Fullerene Author: Filippone, S.; Martín, N.; Altable, M.; Martin-Domenech, A.; Solà, M.; Poater, A.
Conference: XII Trobada de Joves Investigadors dels Països Catalans. (ESP) 2022. Title: Catalitzadors bis(fenoxi‐imina) fluxionals per a la polimerització de polietilè Author: S. Escayola, A. Brotons-Rufes, N. Bahri-Laleh, F. Ragone, L. Cavallo, M. Solà, A. Poater, "Fluxional bis(phenoxy-imine) Zr and Ti catalysts for polymerization"; Theor Chem Acc 2021 140, 49. DOI: https://doi.org/10.1007/s00214
Conference: International School on Innovations in Homogeneous and Supported Homogeneous Catalysis (ISI-HSHC). Bucharest (ROM) 2023. Title: Indolizine synthesis through annulation of pyridinium 1,4-thiolates and copper carbenes: a predictive catalysis approach Author: Roger Monreal-Corona; Àlex Díaz-Jiménez; Anna Roglans; Albert Poater; Anna Pla-Quintana Conference: XXXVIII Reunión Bienal de la Real Sociedad Española de Química. (ESP) 2023. Title: SYNTHESIS OF HIGHLY FUNCTIONALIZED 1H-ISOINDOLES VIA A Rh(II)- CATALYZED CASCADE REACTION INVOLVING CARBENE/ALKYNE METATHESIS AND NITRILES Author: Àlex Díaz-Jiménez; Roger Monreal-Corona; Miquel Solà; Albert Poater; Anna Roglans; Anna Pla-Quintana Conference: 1a Reunió de Química Teòrica i Computacional. Barcelona (ESP) 2023. Title: L'Intrigant Aromaticitat de les (sub)ftalocianines Author: Sílvia Escayola; Albert Poater; Miquel Solà; Eduard Matito Conference: Reunión Bienal de la Sociedad Española de Catálisis (SECAT'23). Torremolinos (ESP) 2023. Title: Indolizine synthesis through annulation of pyridinium 1,4-thiolates and copper carbenes: a predictive catalysis approach Author: Roger Monreal-Corona; Àlex Díaz-Jiménez; Anna Roglans; Albert Poater; Anna Pla-Quintana Conference: XXVIII Reunión Bienal del Grupo Especializado de Química Orgánica. (ESP) 2023. Title: SYNTHESIS OF HIGHLY FUNCTIONALIZED 1H-ISOINDOLES VIA A Rh(II)- CATALYZED CASCADE REACTION INVOLVING CARBENE/ALKYNE METATHESIS AND NITRILES Author: Àlex Díaz-Jiménez; Roger Monreal-Corona; Miquel Solà; Albert Poater; Anna Roglans; Anna Pla-Quintana Conference: 12th Congress on Electronic Structure Principles and Applications (ESPA). Vigo (ESP) 2022. Title: The Intriguing Aromaticity of (Sub)Phthalocyanines Author: Sílvia Escayola; Eduard Matito; Albert Poater; Miquel Solà Conference: World Association of Theoretical and Computational Chemists (WATOC). Vancouver (CAN) 2022. Title: A DFT study of the nitrous oxide functionalization for the preparation of triazolopyridine and triazoloquinoline scaffolds Author: Roger Monreal-Corona; Emili Besalú; Anna Pla-Quintana; Albert Poater Conference: 14th Girona Seminar. Girona (ESP) 2022. Title: Global and Local Aromaticity of (Sub)Phthalocyanines Author: Sílvia Escayola; Dariusz W. Szczepanik; Albert Poater; Miquel Solà; Eduard Matito Conference: 29th Canadian Symposium on Theoretical and Computational Chemistry (CSTCC). Kelowna, BC (CAN) 2022. Title: A DFT study of the nitrous oxide functionalization for the preparation of triazolopyridine and triazoloquinoline scaffolds Author: Roger Monreal-Corona; Emili Besalú; Anna Pla-Quintana; Albert Poater Conference: 2021 #RSCPoster Twitter Conference. Royal Society of Chemistry (ENG) 2021. Title: Guidelines for tuning the excited State Hückel-Baird hybrid aromatic character of pro-aromatic quinoidal compounds Author: Escayola, S.; Tonnelé, C.; Matito, E.; Poater, A.; Ottosson, H.; Solà, M.; Casanova, D. Conference: Uppsala University 5th PhD Chemistry Miniconference. Uppsala (SWE) 2021. Title: Guidelines for Tuning the Excited State Hückel‐Baird Hybrid Aromatic Character of Pro‐Aromatic Quinoidal Compounds Author: Sílvia Escayola; Claire Tonnelé; Eduard Matito; Albert Poater; Henrik Ottosson; Miquel Solà; David Casanova Conference: @ESOR2021online Conference. Amsterdam (NLD) 2021. Title: Understanding the excited state aromaticity of pro-aromatic quinoidal compounds Author: Escayola, S.; Tonnelé, C.; Matito, E.; Poater, A.; Ottosson, H.; Solà, M.; Casanova, D. Conference: Virtual Winter School for Computational Chemistry (CECAM). (CHE) 2021. Title: Guidelines for Tuning the Excited State Hückel-Baird Hybrid Aromatic Character of Pro-Aromatic Quinoidal Compounds Author: Sílvia Escayola; Claire Tonnelé; Eduard Matito; Albert Poater; Henrik Ottosson; Miquel Solà; David Casanova Conference: Emerging concepts in solar energy conversion - from computation to implementation. Thuwal (SAU) 2020. Title: Do Carbon nano-onions Behave as Nanoscopic Faraday Cages? C60, C240, C60@C240 & Li+ Author: Jesús Antonio Luque Urrutia; Albert Poater; Miquel Solà Conference: Tools for Chemical Bonding (TCB2019). Bremen (DEU) 2019. Title: From Linear to Circular Polycyclic Compounds: Aromaticity study on Singlet and Triplet States Author: Sílvia Escayola, Dariusz W. Szczepanik, Albert Poater, Miquel Solà Conference: First International Conference on Excited State Aromaticity and Antiaromaticity (ICESAA). Sigtuna (SWE) 2019. Title: Global and Local Aromaticity Reversals Between Singlet and Triplet States an Expanded Porphyrins Author: Escayola, S.; Szczepanik, D. W.; Poater, A.; Solà, M. Conference: XXXV XRQTC Annual Meeting. (ESP) 2019. Title: The influence of the pH on the reaction mechanism of water oxidation by a Ru(bda) catalyst Author: Jesús Antonio Luque Urrutia, Albert Poater i Teixidor, Miquel Solà i Puig Conference: Tools for chemical Bonding. Bremen (DEU) 2019. Title: From linear to circular polycyclic compounds: Aromaticity Study on Singlet and Triplet States Author: S. Escayola, D. W. Szczepanik, A. Poater, M. Solà Conference: ESQC - European Summerschool in Quantum Chemistry. Palermo (ITA) 2019. Title: Exploring the Performance of Different Aromaticity Indicators in Expanded Porphyrin Systems Author: Sílvia Escayola, Dariusz Szczepanik, Albert Poater and Miquel Solà Conference: 4th EMN Meeting on Computation and Theory. San Sebastian (ESP) 2018. Title: Diastereoisomerism in platinum(II) phosphino- and aminothiolato hydrido complexes Author: Alfonso Polo; Josep Duran; Albert Poater; Julio Real; Miquel Solà Conference: Girona Seminar 2018: Predictive Catalysis, Transition-Metal Reactivity by Design. Girona (ESP) 2018. Title: Mechanism study of the water oxidation catalyst Ru 4,4'-bipicoline 2,2'-bipyridine-6,6'-dicarboxylate [Ru(bda)(pic)2]' Author: A. Luque-Urrutia, A. Poater, M. Solà Conference: Aromaticity 2018. Riviera Maya (MEX) 2018. Title: The effect of exocyclic substituents and π-system length on the electronic structure of Chichibabin diradicaloids Author: Escayola, S.; Callís, M.; Poater, A.; Solà, M. Conference: Girona Seminar 2018: Predictive Catalysis, Transition-Metal Reactivity by Design. Girona (ESP) 2018. Title: The preference for dual-gold(I) catalysis in the hydro(alkoxylation vs. phenoxylation) of alkynes Author: P. Besalú-Sala, È. Casals-Cruañas, O. F. González-Belman, D. J. Nelson, A. Poater Conference: 11th Congress on Electronic Structure Principles and Applications (ESPA-2018). Toledo (ESP) 2018. Title: How to reduce NO2 computationally by pincer based metal catalysts Author: A. Poater Conference: Girona Seminar 2018. (ESP) 2018. Title: THE PREFERENCE FOR DUAL-GOLD(I) CATALYSIS IN THE HYDRO(ALKOXYLATION VS PHENOXYLATION) OF ALKYNES Author: Pau Besalú-Sala, Èric Casals-Cruañas, Oscar F. González-Belman, David J. Nelson, Albert Poater* Conference: ESCB2. Oviedo (ESP) 2018. Title: the mechanism of acceptorless dehydrogenative coupling of nitriles and alcohols by a mn-pincer catalyst Author: Jesús A. Luque-Urrutia, Albert Poater, Miquel Solà Conference: Girona Seminar 2018: Predictive Catalysis, Transition-Metal Reactivity by Design. Girona (ESP) 2018. Title: The role of the metal in the dual-metal catalysed hydrophenoxylation of diphenylacetylene Author: O. F. González-Belman, J. O. C. Jiménez-Halla, F. Nahra, C. S. J. Cazin, A. Poater Conference: 7th EuCheMS Chemistry Congress; Liverpool. Liverpool (GBR) 2018. Title: Dual-metal catalysed hydrophenoxylation of diphenylacetylene Author: A. Poater Conference: Girona Seminar (GiSem). (ESP) 2018. Title: the importance of the oxidation state of the metal in olefin metathesis catalysis. Author: Martí Gimferrer; Pedro Salvador and Albert Poater. Conference: KAUST Research Conference: Polymers-Designing Macromolecules for Applications. Jeddah (SAU) 2017. Title: Enantioselective polymerization of epoxides using biaryl-linked bimetallic cobalt catalysts Author: A. Poater Conference: 253rd ACS National Meeting. San Francisco (USA) 2017. Title: Benzene in olefin metathesis by Ru-based catalysts Author: A. Poater, J. Poater, R. Chauvin Conference: Tools for chemical bonding. Bremen (DEU) 2017. Title: From linear to circular polycyclic compounds: Aromaticity Study on Singlet and Triplet States Author: Escayola, S.; Szczepanik, D. W.; Poater, A.; Solà, M. Conference: Reunión Mexicana de Fisicoquímica Teórica. Ciudad de la Puebla (MEX) 2017. Title: El papel del metal en la hidrofenoxilación de alquinos doblemente catalizada Author: O. F. González-Belman, A. Poater, J. O. C. Jiménez-Halla Conference: 253rd ACS National Meeting. San Francisco (USA) 2017. Title: Interaction of olefin metathesis and fullerenes Author: A. Poater Conference: International Symposium on Synthesis and Catalysis (ISySyCat). Evora (PRT) 2017. Title: Iron Based Frustrated Lewis Pairs: from DFT to Applications in Alkylation of Ketones Author: S. Coufourier, C. Seck, M. D. Mbaye, A. Lator, A. Poater, S. Gaillard, J.-L. Renaud Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: Reaction mechanism of the rhodium-catalyzed arylation of fullerene with organoboron compounds in water Author: A. Poater, M. Solà, J. Martínez Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: Sterical index to predict the reactivity of alkynes Author: A. Poater, M. Michalak Conference: International Symposium on Homogeneous Catalysis ISHCXX. Kyoto (JPN) 2016. Title: On the Mechanism of the Dual Metal Catalysis Author: A. Poater, L. Cavallo Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: Olefin metathesis with Ru-based catalysts containing N-heterocyclic carbenes attached to fullerenes Author: A. Poater, M. Solà, J. Martínez Conference: 250th ACS National Meeting. Boston (USA) 2015. Title: Mechanism of intramolecular rhodium and palladium catalyzed alkene alkoxyfunctionalizations (CATL 228) Author: M. Alghamdi, L. Cavallo, A. Poater, L. Falivene Conference: 16th Tetrahedron Symposium. Berlín (DEU) 2015. Title: Computational Challenges in Olefin Metathesis Author: A. Poater Conference: KAUST research Conference: Catalytic Carbon and Hydrogen Management. Thuwal (SAU) 2015. Title: Computational Challenges in Olefin Metathesis Author: A. Poater Conference: The 2nd International Conference on Organometallics and Catalysis (OM&Cat-2014). Nara (JPN) 2014. Title: Computational Challenges in Olefin Metathesis Author: A. Poater Conference: 248th ACS National Meeting. San Francisco (USA) 2014. Title: Computational hints in Fe-based catalysts Author: A. Poater, L. Cavallo, E. Pump, S. V. C. Vummaletti Conference: 245th ACS National Meeting. New Orleans (USA) 2013. Title: Is water a source of energy? Author: A. Poater, M. Solà, A. Llobet, L. Cavallo Conference: 245th ACS National Meeting. New Orleans (USA) 2013. Title: Electronic properties of CNNs: A journey toward nanomedicine Author: A. Poater, A. Gallegos-Saliner, L. Cavallo, M. Solà, A. P. Worth Conference: 4th International Conference on Drug Discovery and Therapy. Dubai (ARE) 2012. Title: Tuning the electronic properties of NanoParticles: a journey towards NanoMedicine Author: A. Poater, F. Ragone, M. Garrido, S. Pérez, M. Poch, A. Correa, L. Cavallo Conference: 2nd Nanotoxicology Conference. Venècia (ITA) 2007. Title: Modelling NanoNeedles: a journey towards Nanomedicine Author: Poater, A.; Gallegos, A.; Worth, A.P. Conference: ESF-EMBO Symposium conference on Probing Interactions between Nanoparticles/Biomaterials and Biological Systems - Alternative Approaches to Bio- and N. Sant Feliu de Guíxols (ESP) 2007. Title: Nanomedical applications of modelling carbon-based nanoneedles Author: Poater, A.; Gallegos, A.; Worth, A.P. Conference: Chemical Reactivity. A three day International Conference on Theoretical Aspects of Reactivity. Brusel·les (BEL) 2006. Title: Mechanism of the insertion of molecular oxygen in hexaaza macrocyclic dinuclear complexes Author: Poater, A.; Ribas, X.; Costas, M.; Duran, M.; Llobet, A.; Solà, M. Conference: 11th International Conference on the Applications of Density Functional Theory in Chemistry and Physics (DFT2005). Ginebra (CHE) 2005. Title: Selective bond activation in aromatic systems by transition metals Author: Poater, A.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: 17th International Symposium on Olefin Metathesis and Related Chemistry. Pasadena (USA) 2005. Title: A Computational Study on the Wanzlick Equilibrium Author: C. Costabile, F. Ragone, A. Poater, R. Dorta, L. Cavallo Conference: Recent advances in catalysis (RAC) 2005. Rennes (FRA) 2005. Title: Synthesis, structural characterization, atropisomeric discrimination and catalytic activity of new ruthenium complexes containing chiral oxazoline ligands Author: Llobet, A.; Mola, J.; Parella, T.; Plantalech, E.; Poater, A.; Rodríguez, M.; Romero, I.; Sala, X.; Serrano, I.; Solà, M. Conference: Molecular Crystal Engineering. EuroConference on Evaluations and Predictions of Solid State Materials Properties. Helsinki (FIN) 2005. Title: Theoretical Characterization of the Reactivity of the Copper Clusters Cu<sub>n</sub> (n=1-9) with CO Author: Poater, A.; Jaque, P.; Duran, M.; Toro-Labbé, A.; Solà, M. Conference: 9th International Symposium Activation of Dioxygen and Homogeneous Catalytic Oxidation (ADHOC 2005). Colonia (DEU) 2005. Title: Structurally related Biomimetic Dinuclear Cu Complexes Yielding Different Oxygenated Cu2O2 species With Different Intramolecular Aromatic Hydroxylation Reactivity Author: Company, A.; Ribas, X.; Poater, A.; Solà, M.; Mahía, J.; Costas, M.; Llobet, A. Conference: XX Reunió de la Xarxa de Química Teòrica de Catalunya. Barcelona (ESP) 2004. Title: Mechanism of the activation of C-H bonds in aromatic systems by mu-phenoxo-mu-hydroxo complexes Author: Poater, A.; Costas, M.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: Conference in the Honor of Prof. Nicholas C. Handy: Molecular Quantum Mechanics. Cambridge (GBR) 2004. Title: Activation of C-H aromatic bonds by transition metals Author: Poater, A.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: GECOM-CONCOORD 2004 (Groupe d’Etude en Chimie Organométallique-Concentration en Chimie de Coordination). Bayonne-Anglet-Biarritz (FRA) 2004. Title: Diastereoisomerism in platinum(II) 2-phosphino and 2-aminothiolato complexes Author: Duran Carpintero, J.; Polo, A.; Real, J.; Poater, A.; Solà, M.; Benet-Buchholz, J. Conference: EURESCO Conference on New Theoretical and Spectroscopical Approaches to Inorganic Chemistry Problems. Sant Feliu de Guíxols (ESP) 2004. Title: Electronic and structural effects in the activation of O<sub>2</sub> by biomimetic dinuclear copper macrocyclic complexes Author: Poater, A.; Costas, M.; Ribas, X.; Xifra, R.; Company, A.; Duran, M.; Llobet, A.; Solà, M. Conference: EURESCO Conference on New Theoretical and Spectroscopical Approaches to Inorganic Chemistry Problems. Sant Feliu de Guíxols (ESP) 2004. Title: Mechanism of the activation of C-H bonds in aromatic systems by Cu Author: Poater, A.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, M.; Solà, M. Conference: GECOM-CONCOORD 2004 (Groupe d’Etude en Chimie Organométallique-Concentration en Chimie de Coordination). Bayonne-Anglet-Biarritz (FRA) 2004. Title: Synthesis, structural characterization and atropisomeric discrimination of new ruthenium complexes containing chiral oxazoline ligands Author: Llobet, A.; Plantalech, E.; Poater, A.; Rodríguez, M.; Romero, I.; Sala, X.; Serrano, I.; Solà, M. Conference: Faraday Discussion 124: Quantum Inorganic Chemistry. York (GBR) 2003. Title: Mechanism of the C-H bond activation in aromatic systems by µ-phenoxo-µ-hydroxo complexes Author: Poater, A.; Costas, M.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: 2nd Quantum Bioinorganic Chemistry Conference (QBIC). Örenas Castle (SWE) 2002. Title: Theoretical study of the activation of C-H bonds in aromatic systems by transition metals Author: Poater, A.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: X Reunión Científica Plenaria de Química Inorgánica - IV Reunión Científica Plenaria de Química del Estado Sólido (QIES). Còrdoba (ESP) 2002. Title: Activation of C-H bonds in aromatic systems by -phenoxo -hydroxo complexes Author: Llobet, A.; Poater, A.; Romero, M.I.; Sala, X.; Sens, C. Conference: International Conference on Electronic Structure: Principles and Applications (ESPA 2002). Sevilla (ESP) 2002. Title: Activation of C-H bonds in aromatic systems by mu-phenoxo-mu-hydroxo complexes Author: Poater, A.; Ribas, X.; Xifra, R.; Duran, M.; Llobet, A.; Solà, M. Conference: 4th World Congress on Oxidation Catalysis (WCOC). Berlín (DEU) 2001. Title: Tailored ligand design for the synthesis of selective oxidation copper catalyst complexes Author: Llobet, A.; Anda, C.; Costas, M.; Martinez-Lorente, M.A.; Moradell, S.; Nadal, J.; Poater, A.; Ribas, X.; Rodríguez, M.; Romero, M.I.; Sens, C.; Xifra, R.
Conference: Congrés Internacional de Docència Universitària (CIDUI). Lleida (ESP) 2023. Title: Aplicació de la metodologia de l'aula inversa en una assignatura de química descriptiva Author: Poater, Albert; Polo, Alfons; Duran, Josep Conference: Reunión Bienal de la Sociedad Española de Catálisis (SECAT'23). Torremolinos (ESP) 2023. Title: Homogenizing Heterogeneous Catalysts: Carbon Dioxide Conversion as a Case Example Author: Posada-Pérez, S.; Vidal López, A.; Solà, M.; Poater, A Conference: Reunión Bienal de la Sociedad Española de Catálisis (SECAT'23). Torremolinos (ESP) 2023. Title: Indolizine synthesis through annulation of pyridinium 1,4-thiolates and copper carbenes: a predictive catalysis approach Author: Roger Monreal-Corona; Àlex Díaz-Jiménez; Anna Roglans; Albert Poater; Anna Pla-Quintana Conference: International School on Innovations in Homogeneous and Supported Homogeneous Catalysis (ISI-HSHC). Bucharest (ROM) 2023. Title: Indolizine synthesis through annulation of pyridinium 1,4-thiolates and copper carbenes: a predictive catalysis approach Author: Roger Monreal-Corona; Àlex Díaz-Jiménez; Anna Roglans; Albert Poater; Anna Pla-Quintana Conference: 1a Reunió de Química Teòrica i Computacional. Barcelona (ESP) 2023. Title: L'Intrigant Aromaticitat de les (sub)ftalocianines Author: Sílvia Escayola; Albert Poater; Miquel Solà; Eduard Matito Conference: 15th annual International Conference of Education, Research and Innovation (ICERI2022). Sevilla (ESP) 2022. Title: Project-based learning to understand the steric effect of chemical ligands by a web-server Author: A. Poater Conference: Trobada de Joves Investigadors dels Països Catalans. (ESP) 2022. Title: Catalitzadors bis(fenoxi‐imina) fluxionals per a la polimerització de polietilè Author: A. Brotons-Rufes, A. Poater Conference: FCCat 2022 : French Conference on Catalysis 2022. (FRA) 2022. Title: Predictive Catalysis by DFT: Generation of H2 and Fixation of CO2, N2O Author: A. Poater Conference: JODOC 2022. (ESP) 2022. Title: Computational analysis of 1,3-dipolar reaction inside carbon nanotubes Author: M. Tomasini, A. Poater Conference: Math/Chem/Comp 2022 - 33rd MC2 Conference. Online (CRO) 2022. Title: The Intriguing Aromaticity of (Sub)Phthalocyanines Author: Sílvia Escayola; Dariusz W. Szczepanik; Albert Poater; Miquel Solà; Eduard Matito Conference: Cutting-Edge Homogeneous Catalysis (CEHC-2). (DEU) 2022. Title: Predictive Catalysis: Generation of H2 and fixation of CO2 and N2O by DFT Author: A. Poater Conference: Journées Nord-Ouest Européennes des Jeunes Chercheurs. Caen (FRA) 2022. Title: Alkylation of Benzoyl Hydrazines: Access to Mono- or Di-Substituted Compounds. Author: Joly, N.; Bettoni, L.; Gaillard, S.; Poater, A.; Renaud J.-L. Conference: Journée de l'École Doctorale Normande de Chimie. Caen (FRA) 2022. Title: Alkylation of Benzoyl Hydrazines: Access to Mono- or Di-Substituted Compounds. Author: Joly, N.; Bettoni, L.; Gaillard, S.; Poater, A.; Renaud J.-L. Conference: 9th European Conference on Boron Chemistry. Barcelona (ESP) 2022. Title: Arylic C-H Bond Activation and Borylation Author: M. Tomasini, L. Falivene, L. Caporaso, J. Poater, R. Gramage, A. Poater Conference: ACS Fall 2022 - Sustainability In a Changing World. Chicago (USA) 2022. Title: Tuning the electronic nature of excited conjugated rings Author: Sílvia Escayola; Claire Tonnelé; Eduard Matito; Albert Poater; Henrik Ottosson; Miquel Solà; David Casanova Conference: JODOC 2022. (ESP) 2022. Title: A DFT study of the N2O functionalization for the preparation of traizolopyridine and triazoloquinoline scaffolds Author: R Monreal-Corona, E. Besalú, A. Pla-Quintana, A. Poater Conference: Young Reserachers Symposium (Girona Seminar). Girona (ESP) 2022. Title: Global and Local Aromaticity of (Sub)Phthalocyanines Author: Sílvia Escayola; Dariusz W. Szczepanik; Albert Poater; Miquel Solà; Eduard Matito Conference: 12a Trobada de Joves Investigadors dels Països Catalans. Online (ESP) 2022. Title: La importància del bite angle dels Metall(III)‐Salen catalitzadors en el segrest de CO2 amb epòxids en condicions suaus Author: A. Vidal-López, A. Poater Conference: VIth Conference of Predoctoral Researchers - UdG. Girona (ESP) 2022. Title: Understanding the electronic structure of excited state aromatic systems and macrocycles Author: Sílvia Escayola; Albert Poater; Miquel Solà; Eduard Matito Conference: INTED 2022. Valencia (ESP) 2022. Title: Girona Chemical Itinerary: 14 years and a pandemic Author: Duran, J., Vieta, P.A., Fernández-Martínez, J., Poater, J., Duran, M., Simon, S., Ametller, J., Cornellà, P. Conference: 9th Young Scientist Workshop on Theoretical Chemistry and Computational Modelling. Vigo (ESP) 2022. Title: The Intriguing Aromaticity of (Sub)Phthalocyanines Author: Sílvia Escayola; Albert Poater; Miquel Solà; Eduard Matito Conference: VI Conference of Predoctoral Researchers of the University of Girona . Girona (ESP) 2022. Title: Alkylation of Benzoyl Hydrazines: Access to Mono- or Di-Substituted Compounds. Author: Joly, N.; Bettoni, L.; Gaillard, S.; Poater, A.; Renaud J.-L. Conference: 12th edition of the CπC (Computing π-Conjugated Compounds) symposium. (SWE) 2021. Title: Aromaticity of Excited Conjugated Rings: Baird or Hückel? Author: Sílvia Escayola; Claire Tonnelé; Eduard Matito; Albert Poater; Henrik Ottosson; Miquel Solà; David Casanova Conference: V Jornades d'Investigadors Predoctorals de la Universitat de Girona. Girona (ESP) 2021. Title: Guidelines for tuning the excited state Hückel-Baird hybrid aromatic character of pro-aromatic quinoidal compounds Author: Escayola, S.; Tonnelé, C.; Matito, E.; Poater, A.; Ottosson, H.; Solà, M.; Casanova, D. Conference: V Jornades d'Investigadors Predoctorals de la UdG / V Jornadas de Investigadores Predoctorales de la UdG / V Conference of Pre-doctoral Researchers of. (ESP) 2021. Title: A predictive journey towards trans-thioamides/amides Author: M. Tomasini, L. Falivene, M. Szostak, A. Poater Conference: V Jornades d'Investigadors Predoctorals de la Universitat de Girona. Girona (ESP) 2021. Title: Intermolecular carbene trapping Author: R. Monreal-Corona, A. Díaz-Jiménez, A. Poater, A. Pla-Quintana Conference: e-EUCO-CTC 2021. (BEL) 2021. Title: Tuning the Aromaticity of Excited para-quinodimethanes Author: Escayola, S.; Tonnelé, C.; Matito, E.; Poater, A.; Ottosson, H.; Solà, M.; Casanova, D. Conference: 13th European Conference on Computational and Theoretical Chemistry - EuChemS Division of Computational and Theoretical Chemistry (e-EuCo-CTC 2021). Online (HUN) 2021. Title: Tuning the Aromaticity of Excited para-quinodimethanes Author: Sílvia Escayola; Claire Tonnelé; Eduard Matito; Albert Poater; Henrik Ottosson; Miquel Solà; David Casanova Conference: XII Jornadas de Jóvenes Investigadores en Física Atómica y Molecular (J2IFAM2020). Bilbao (ESP) 2020. Title: Tuning the diradical character of chichibabin compounds: effect of π-system length and exocyclic substituents on the electronic structure Author: Sílvia Escayola, Albert Poater, Miquel Solà Conference: XXXVII Reunión Bienal de la Real Sociedad Española de Química. San Sebastián (ESP) 2019. Title: Mechanism of the Manganese-Pincer Catalyzed Acceptorless Dehydrogenative Coupling of Nitriles and Alcohols Author: Jesús Antonio Luque Urrutia, Miquel Solà i Puig, David Milstein, Albert Poater i Teixidor Conference: III Conference of Pre-doctoral Researchers of the UdG. Girona (ESP) 2019. Title: From Linear to Circular Polycyclic Compounds: Aromaticity Study on Singlet and Triplet States Author: Sílvia Escayola, Dariusz Szczepanik, Albert Poater and Miquel Solà Conference: XVI Simposio Jóvenes Investigadores. Valencia (ESP) 2019. Title: Hydrogenation complementing the generation of H2: on the way to green chemistry Author: J. A. Luque-Urrutia, M. Gimferrer, S. Escayola, J. L. Renaud, D. Milstein, A. Poater Conference: Desena trobada de joves investigadors dels països catalans. Barcelona (ESP) 2018. Title: Estudi del catalitzador 2,2-bipiridina-6,6-dicarboxilat de Ru com a catalitzador per oxidació de l'aigua Author: Jesús Antonio Luque Urrutia; Albert Poater Teixidor; Miquel Solà i Puig Conference: Girona Seminar 2018, young researcher symposium. Girona (ESP) 2018. Title: Mechanism study of 2,2'-bypyridine-6,6'-dicarboxilate Ru catalyst as a water oxidation catalyst Author: Luque-Urrutia; J. A.; Poater, A.; Solà, M. Conference: Girona Seminar. Girona (ESP) 2018. Title: 2,2'-bipyridine-6,6-dicarboxylate ru as a water oxidation catalyst: 2 possible mechanisms? Author: Jesús A. Luque-Urrutia, Albert Poater, Miquel Solà Conference: 256th ACS National Meeting. Boston (USA) 2018. Title: Covalent and ionic capacity of MOFs to sorb gases (ORGN 530) Author: A. Poater Conference: Desena Trobada de Joves Investigadors dels Països Catalans. Barcelona (ESP) 2018. Title: Estudi del catalitzador 2,2'-bipiridina-6,6-dicarboxilat de Ru com a catalitzador per oxidació de l'aigua Author: J. A. Luque-Urrutia, Miquel Solà, A. Poater Conference: 253rd ACS National Meeting. San Francisco (USA) 2017. Title: Evolution of reactivity of olefin metathesis of Ru, and a step forward to other metals Author: A. Poater Conference: 9a Trobada de Joves Investigadors dels Països Catalans. Perpignan (FRA) 2016. Title: Reusable manganese compounds containing pyrazole-based ligands for olefin epoxidation reactions Author: Ester Manrique, Albert Poater, Xavier Fontrodona, Miquel Solà, Montserrat Rodríguez, Isabel Romero Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: New generations of olefin metathesis catalysts Author: A. Poater, R. Chauvin Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: O-O bond formation in woc by iridium complexes Author: A. Poater, L. Cavallo Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: On the mechanism of the dual metal catalysis Author: A. Poater, S. Vummaleti, L. Falivene Conference: 6th EUCHEMS Chemistry Congress. Sevilla (ESP) 2016. Title: New Insights into the Mechanism of Iridium Catalyzed Water Oxidation Driven by CAN Author: A. Bucci, G. Menendez Rodriguez, G. Bellachioma, C. Zuccaccia, A. Poater, L. Cavallo, A. Macchioni Conference: 251st ACS National Meeting. San Diego (USA) 2016. Title: Dual gold catalysis to functionalize alkynes Author: A. Poater Conference: 42nd International Congress of Theoretical Chemists of Latin Expression. Montevideo (URY) 2016. Title: Prediction of the reactivity of olefin metathesis by Ru-based catalysts through a web-server'(oral communication); QUITEL2016 Author: A. Poater Conference: XII Simposio de Investigadores Jóvenes de la Real Sociedad Española de Química. Logroño (ESP) 2016. Title: Mono vs Dual Metal Catalysis Author: A. Poater Conference: 249th ACS National Meeting. Denver (USA) 2015. Title: How to get selective organo(hydro)fullerenes through Rh/organoboron combination (ORGN 68) Author: A. Poater, J. P. Martínez, M. Solà Conference: 250th ACS National Meeting. Boston (USA) 2015. Title: Hydrophenoxylation of alkynes by cooperative gold catalysis (CATL 330) Author: A. Poater, S. Vummaleti, L. Cavallo, S. P. Nolan Conference: 249th ACS National Meeting. Denver (USA) 2015. Title: Innocent role of Sc3+ on a non-heme Fe catalyst in an O2 environment (INOR 867) Author: A. Poater, S. V. C. Vummaleti, L. Cavallo Conference: 250th ACS National Meeting. Boston (USA) 2015. Title: Computational challenges in olefin metathesis (ORGN 301) Author: A. Poater Conference: 250th ACS National Meeting. Boston (USA) 2015. Title: Oxidative addition of arylchloride to mono ligated and bi-ligated linear/bent AuI and Pd0 complexes Author: S. Vummaleti, l. Falivene, A. Poater, L. Cavallo Conference: 249th ACS National Meeting. Denver (USA) 2015. Title: Comparing Ru and first row transition metal-catalyzed olefin metathesis (INOR 774) Author: Albert Poater Conference: 248th ACS National Meeting. San Francisco (USA) 2014. Title: Computational hints in olefin metathesis Author: A. Poater, S. P. Nolan, D. J. Nelson, S. Manzini, C. A. Urbina-Blanco, L. Falivene, S. V. C. Vummaletti, L. Cavallo Conference: XXX Annual Meeting aof the Reference Network of R+D+I on Theoretical and Computational Chemistry. Barcelona (ESP) 2014. Title: (De)activation of Ru-based olefin metathesis catalysts Author: A. Poater Conference: Conference on C<br>C Bond Cleavage (CCCC). Kyoto (JPN) 2014. Title: Computational Challenges in Olefin Metathesis Author: A. Poater Conference: ESPA2014. Badajoz (ESP) 2014. Title: Activation and Deactivation of Ru-based Olefin Metathesis Catalysts Author: A. Poater Conference: Molecular Complexity in Modern Chemistry' (MCMC-2014). Moscú (RUS) 2014. Title: Activation of Ru-based olefin metathesis catalysts Author: A. Poater Conference: 245th ACS National Meeting. New Orleans (USA) 2013. Title: Activation mechanism of Ru-indenylidene complexes in olefin metathesis Author: A. Poater, L. Cavallo Conference: 245th ACS National Meeting. New Orleans (USA) 2013. Title: Complete * intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper(I) complex Author: A. Poater, L. Cavallo Conference: 245th ACS National Meeting. New Orleans (USA) 2013. Title: Mechanism of epoxide polymerization by bimetallic Co-salen catalysts Author: A. Poater, L. Cavallo Conference: International Conference on Computational Science (ICC2013). Barcelona (ESP) 2013. Title: Steric maps to evaluate the role of steric hindrance on the IPr NHC ligand Author: A. Poater, L. Falivene, C.A. Urbina-Blanco, S. Manzini, S.P. Nolan, L. Cavallo Conference: 12th Eurasia Conference on Chemical Sciences (EuAsC2S-12). Corfu (GRC) 2012. Title: The role of alcohols in olefin metathesis Author: A. Poater, L. Cavallo Conference: Girona Seminar X: on Theoretical and Computational Chemistry for the Modeling of Biochemical Systems: From Theory to Applications. girona (ESP) 2012. Title: From olefin metathesis to the synthesis of drugs Author: A. Poater, L. Cavallo Conference: EUMET-42. St. Andrews (SCO) 2012. Title: Insights in Olefin metathesis Author: A. Poater, L. Cavallo Conference: 244th ACS National Meeting. Filadèlfia (USA) 2012. Title: Deactivation of Ru based olefin metathesis catalysts Author: A. Poater, L. Cavallo Conference: 26th Molecular Modelling Workshop. erlangen (DEU) 2012. Title: (De)Activation for olefin metathesis catalysts Author: A. Poater, L. Cavallo Conference: International Conference on Computational Science. Singapur (SGP) 2011. Title: Deactivation of Ru-(benz)ylidene Grubbs catalysts active in olefin metathesis Author: A. Poater, F. Ragone, M. Garrido, S. Pérez, M. Poch, A. Correa, L. Cavallo Conference: 242nd National Meeting of the American-Chemical-Society (ACS). Denver (USA) 2011. Title: New carbon- and sulfur-based ligands in late-transition metal catalysis Author: R. Mariz, X.J. Luan, M. Gatti, E. Drinkel, J.J. Burgi, L. Wu, F. Gaggia, S. Blumentritt, A. Linden, C. Costabile, L. Cavallo, A. Poater, R. Dorta Conference: EUMET-M36. Varsòvia (POL) 2011. Title: New generation of Ru metathesis catalysts Author: A. Poater, R. Credendino, L. Cavallo Conference: EUMET-M24. Graz (AUT) 2010. Title: Aromatic deactivations processes in Ru metathesis catalysts Author: A. Poater, L. Cavallo Conference: EUMET-M18. Lyon (FRA) 2010. Title: Mecanistical insights into the formation of indenylidene Author: A. Poater, L. Cavallo Conference: Dalton Discussion 12: Catalytic C-H and C-X Bond Activation. Durham (ENG) 2010. Title: Molecular mechanism of acid-triggered aryl-halide cross-coupling reaction via reductive elimination in well-defined aryl-Cu(III)-halide species Author: A. Casitas, A. Poater, M. Solà, S. S. Stahl, M. Costas, X. Ribas Conference: IX Girona Seminar. Girona (ESP) 2010. Title: Is water a source of Energy? Water Oxidation for Hydrogen Production Author: A. Poater, X. Sala, F. Ragone, A, Llobet, M. Solà, M. Poch, L. Cavallo Conference: The 2010 International Chemical Congress of Pacific Basin Societies (Pacifichem). Honolulu (USA) 2010. Title: Is water a source of energy? Author: Poater, A.; Sala, X.; Ragone, F.; Llobet, A.; Solà, M.; Cavallo, L.; Poch, M. Conference: 18th International Symposium on Olefin Metathesis and Related Chemistry (ISOM XVIII). Leipzig (DEU) 2009. Title: Probing Mechanisms of (De)Activation Routes of Ru-based Olefin Metathesis Catalysts Author: A. Poater, F. Ragone, A. Correa, L. Cavallo Conference: EUMET-M06. St. Andrews (SCO) 2009. Title: The role of a -Acid Ligand Trans to the Ru-ylidene Bond. WP2 flash report Author: A. Poater, F. Ragone, A. Correa, L. Cavallo Conference: EUMET-M12. Salerno (ITA) 2009. Title: The trans-to-cis isomerization problema Author: A. Poater, F. Ragone, A. Correa, L. Cavallo Conference: Meeting on Computational Bio-Inorganic Chemistry. Molecular Graphics and Modeling Society Spring (MGMS). Cardiff (ENG) 2008. Title: Complete Intramolecular Aromatic Hydroxylation Mechanism through O<sub>2</sub> Activation by a Macrocyclic Dinuclear Copper(I) Complex Author: Poater, A.; Ribas, X.; LLobet, A.; Cavallo, L.; Solà, M. Conference: 37th Inorganic Reaction Mechanisms Group Meeting (37IRMGM). Barcelona (ESP) 2008. Title: Mechanistic Insights into the chemistry of Ru(II) complexes containing Cl and dmso ligands Author: Bozoglian, F.; Mola, J.; Romero, I.; Rodríguez, M.; Poater, A.; Solà, M.; Parella, T.; Benet-Buchholz, J.; Fontrodona, X.; Llobet, A. Conference: The 13th International Workshop on Quantitative Structure-Activity Relationships (QSARs) in the Environmental Sciences. Syracuse (USA) 2008. Title: Modelling the structure-property relationships of nanoparticles <br> the use of nanoneedles as potential drug carriers Author: A. Gallegos, A. Poater, A. P. Worth Conference: . Bucarest (ROM) 2008. Title: In Silico Experiments: "Olefin Metathesis Reactions from a Theoretical Perspective Author: L. Cavallo, A. Correa, A. Poater Conference: VIII Girona Seminar on Aromaticity: Basics and Applications. Girona (ESP) 2008. Title: Modelling Structure Property Relationships of Carbon Nanoneedles Author: Poater, A.; Gallegos, A.; Carbó-Dorca, R.; Solà, M.; Worth, A.P. Conference: . Bucarest (ROM) 2008. Title: Deactivation Reactions of Ru-based Catalysts Author: L. Cavallo, A. Poater Conference: Organometallic Chemistry (Gordon Research Conference). Newport (USA) 2007. Title: Optimizing a Catalyst with a DFT Approach Author: O. Eisenstein, X. Solans Monfort, A. Poater, E. Clot, C. Copéret Conference: 232nd ACS National Meeting. San Francisco (USA) 2006. Title: d0 olefin metathesis catalysts: Recipes for an efficient catalyst from a DFT perspective Author: O. Eisenstein, X. Solans-Monfort, A. Poater, J. S. Filhol, E. Clot, C. Copéret Conference: Experiment & Theory in Transition Metal Chemistry: a meeting point. Bellaterra (ESP) 2006. Title: Mechanism of the intramolecular aromatic hydroxylation in a hexaaza macrocyclic dicopper complex Author: Poater, A.; Ribas, X.; Company, A.; Costas, M.; Duran, M.; Llobet, A.; Solà, M. Conference: 17th International Symposium on Olefin Metathesis and Related Chemistry. Pasadena (USA) 2005. Title: Computational Approach to Understand the Mechanism of Ru-Catalyzed Olefin Metathesis Author: A. Poater, A. Correa, L. Cavallo Conference: Oxygen Activation COST Meeting. Girona (ESP) 2004. Title: Dinuclear copper macrocyclic complexes. Ligand modulation of structure and reactivity Author: López, J.M.; Company, A.; Lamata, D.; Ribas, X.; Benet-Buchholz, J.; Poater, A.; Xifra, R.; Mahía, J.; Llobet, A.; Solà, M.; Costas, M. Conference: XX Reunió de la Xarxa de Química Teòrica. Barcelona (ESP) 2004. Title: Efectes electrònics i estructurals en l’activació de l’O<sub>2</sub> mitjançant complexos biomimètics macrocíclics dinuclears de coure Author: Poater, A.; Ribas, X.; Costas, M.; Xifra, R.; Companys, A.; Duran, M.; Llobet, A.; Solà, M. Conference: 6th Girona Seminar on Molecular Similarity. Girona (ESP) 2003. Title: Theoretical characterization of the reactivity of the copper clusters Cu<sub>n</sub> (n=1-9) with CO Author: Poater, A.; Jaque, P.; Duran, M.; Toro-Labbé, A.; Solà, M.