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Robert Zaleśny, RobertW. Góra, Josep M. Luis, Wojciech Bartkowiak
On the particular importance of vibrational contributions to the static electrical properties of model linear molecules under spatial confinement
Phys. Chem. Chem. Phys., 2015, 17, 21782-21786
DOI: 10.1039/c5cp02865e

JuanPablo Martínez, Sílvia Osuna, Miquel Solà, Alexander A. Voityuk
Extent of charge separation and exciton delocalization for electronically excited states in a triphenylamine-C60 donor–acceptor conjugate: a combined molecular dynamics and TD-DFT study
Theor Chem Acc, 2015, 134, 12
DOI: 10.1007/s00214-015-1614-x

Sai Vikrama Chaitanya Vummaleti, Luigi Cavallo, Albert Poater
The driving force role of ruthenacyclobutanes
Theor Chem Acc, 2015, 134, 22
DOI: 10.1007/s00214-015-1622-x

Halina Szatyłowicz, Tadeusz M. Krygowski, Miquel Solà, Marcin Palusiak, Justyna Dominikowska, Olga A. Stasyuk, Jordi Poater
Why 1,2-quinone derivatives are more stable than their 2,3-analogues?
Theor Chem Acc, 2015, 134, 35
DOI: 10.1007/s00214-015-1635-5

Sai Vikrama Chaitanya Vummaleti, Laura Falivene, Albert Poater, Luigi Cavallo
Deconstructing Selectivity in the Gold-Promoted Cyclization of Alkynyl Benzothioamides to Six-Membered Mesoionic Carbene or Acyclic Carbene Complexes
ACS Catal., 2014, 4, 1287-1291
DOI: 10.1021/cs5001575

Adrián Gómez-Suárez, Danila Gasperini, Sai V. C. Vummaleti, Albert Poater, Luigi Cavallo, Steven P. Nolan
Highly Efficient and Eco-Friendly Gold-Catalyzed Synthesis of Homoallylic Ketones
ACS Catal., 2014, 4, 2701-2705
DOI: 10.1021/cs500806m

Simone Manzini, Albert Poater, David J. Nelson, Luigi Cavallo, Alexandra M. Z. Slawin, Steven P. Nolan
Insights into the Decomposition of Olefin Metathesis Precatalysts
Angew. Chem. Int. Ed., 2014, 53, 8995-8999
DOI: 10.1002/anie.201403770

Albert Poater
Environmental friendly Fe substitutive of Ru in water oxidation catalysis
Catalysis Communications, 2014, 44, 2-5
DOI: 10.1016/j.catcom.2013.07.026

Albert Poater, A. Correa, E. Pump, Luigi Cavallo
cis/trans Coordination in Olefin Metathesis by Static and Molecular Dynamic DFT Calculations
Chem Heterocycl Comp, 2014, 50, 389-395
DOI: 10.1007/s10593-014-1491-6

Mireia Rovira, Marc Font, Ferran Acuña-Parés, Teodor Parella, Josep M. Luis, Julio Lloret-Fillol, Xavi Ribas
Aryl-Copper(III)-Acetylides as Key Intermediates in C sp 2 – Csp Model Couplings under Mild Conditions
Chem-Eur J., 2014, 20, 10005-10010
DOI: 10.1002/chem.201402711

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