Publications

Di Pasquale N.; Davie S.J.; Popelier P.L.A., Optimization Algorithms in Optimal Predictions of Atomistic Properties by Kriging, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2016, 12, pp. 1499 - 1513 [Scientific article]

Davie S.J.; Di Pasquale N.; Popelier P.L.A., Kriging atomic properties with a variable number of inputs, «THE JOURNAL OF CHEMICAL PHYSICS», 2016, 145, pp. 104104 - 104104 [Scientific article]

Davie S.J.; Di Pasquale N.; Popelier P.L.A., Incorporation of local structure into kriging models for the prediction of atomistic properties in the water decamer, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2016, 37, pp. 2409 - 2422 [Scientific article]

Di Pasquale N.; Bane M.; Davie S.J.; Popelier P.L.A., FEREBUS: Highly parallelized engine for kriging training, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2016, 37, pp. 2606 - 2616 [Scientific article]

Taddei, Paola; Boga, Carla; Micheletti, Gabriele; Ballarin, Barbara, Vibrational study on the interactions between yak keratin fibres and glyoxylic acid, «JOURNAL OF RAMAN SPECTROSCOPY», 2015, 46, pp. 100 - 108 [Scientific article]

Emilie, Martinelli; Anna Chiara, Vicini; Mancinelli, Michele; Mazzanti, Andrea; Zani, Paolo; Bernardi, Luca; Fochi, Mariafrancesca, Catalytic highly enantioselective transfer hydrogenation of β-trifluoromethyl nitroalkenes. An easy and general entry to optically active β-trifluoromethyl amines, «CHEMICAL COMMUNICATIONS», 2015, 51, pp. 658 - 660 [Scientific article] Open Access

Montante, GIUSEPPINA MARIA ROSA; Paglianti, Alessandro, Fluid dynamics characterization of a stirred model bio-methanation digester, «CHEMICAL ENGINEERING RESEARCH & DESIGN», 2015, 93, pp. 38 - 47 [Scientific article]

Boga, Carla; Zani, Paolo; Micheletti, Gabriele; Ballarin, Barbara; Cino, Silvia, Curly or smooth? Old and new answers, «HOUSEHOLD AND PERSONAL CARE TODAY», 2015, 10, pp. X - XIV [Scientific article]

Lanzi, Massimiliano; Salatelli, Elisabetta; Benelli, Tiziana; Caretti, Daniele; Giorgini, Loris; DI NICOLA, FRANCESCO PAOLO, A regioregular polythiophene-fullerene for polymeric solar cells, «JOURNAL OF APPLIED POLYMER SCIENCE», 2015, 132, pp. 1 - 10 [Scientific article] Open Access

Ylea Vlamidis; Massimiliano Lanzi; Elisabetta Salatelli; Isacco Gualandi; Beatrice Fraboni; Leonardo Setti; Domenica Tonelli, Electrodeposition of PEDOT perchlorate as an alternative route to PEDOT:PSS for the development of bulk heterojunction solar cells, «JOURNAL OF SOLID STATE ELECTROCHEMISTRY», 2015, 19, pp. 1685 - 1693 [Scientific article]

Ciabatti, I.; Femoni, C.; Hayatifar, M.; Iapalucci, M. C.; Zacchini, S., Molecular metal hydride carbonyl clusters, in: Third EuCheMS Inorganic Chemistry Conference - Book of Abstracts, 2015, pp. 66 - 66 (atti di: Third EuCheMS Inorganic Chemistry Conference, Wroclav (Poland), 28 June - 1 July 2015) [Abstract]

Patent WO 2015/197586 A1, Manufacture of o-cresol.

Rossi, Ruggero; Fedrigucci, Andrea; Setti, Leonardo, Characterization of electron mediated microbial fuel cell by saccharomyces cerevisiae, «CHEMICAL ENGINEERING TRANSACTIONS», 2015, 43, pp. 337 - 342 [Scientific article] Open Access

Marco Bortoluzzi;Fabio Marchetti;Guido Pampaloni;Stefano Zacchini, A crystallographically characterized salt of self-generated N-protonated tetraethylurea, «CHEMICAL COMMUNICATIONS», 2015, 51, pp. 1323 - 1325 [Scientific article]

Andrea Baschieri; Sara Muzzioli; Elia Matteucci; Stefano Stagni; Massimiliano Massi; Letizia Sambri, New heterometallic Ir(III)2–Eu(III) complexes: white light emission from a single molecule, «DALTON TRANSACTIONS», 2015, 44, pp. 37 - 40 [Scientific article]

Adriana Mignani; Silvia Fazzini; Barbara Ballarin; Elisa Boanini; Maria Cristina Cassani; Chiara Maccato; Davide Barreca; Daniele Nanni, Mild fabrication of silica-silver nanocomposites as active platforms for environmental remediation, «RSC ADVANCES», 2015, 5, pp. 9600 - 9606 [Scientific article]

Valentina Bleve;Christian Schäfer;Paola Franchi;Serena Silvi;Elisabetta Mezzina;Alberto Credi;Marco Lucarini, Reversible Mechanical Switching of Magnetic Interactions in a Molecular Shuttle, «CHEMISTRYOPEN», 2015, 4, pp. 18 - 21 [Scientific article] Open Access

Benito Martin, P.; Monti, M.; De Nolf, W.; Nuyts, G.; Janssen, G.; Fornasari, G.; Scavetta, E.; Basile, F.; Janssens, F.; Ospitali, F.; Tonelli, D.; Vaccari, A., Improvement in the coating homogeneity in electrosynthesized Rh structured catalysts for the partial oxidation of methane, «CATALYSIS TODAY», 2015, 246, pp. 154 - 164 [Scientific article]

Patricia Benito; Manuel Gregori; Sara Andreoli; Giuseppe Fornasari; Francesca Ospitali; Stefano Millefanti; Maria Sol Avil; Teresita F. Garetto; Stefania Albonetti, Pd-Cu interaction in Pd/Cu-MCM-41 catalysts: effect of silica source and metal content, «CATALYSIS TODAY», 2015, 246, pp. 108 - 115 [Scientific article]

E Del Vecchio; C Boga; L Forlani; S Tozzi; G Micheletti; S Cino, Ring closure of azo compounds to 1,2-annulated benzimidazole derivatives and further evidence of reversibility of the azo-coupling reaction, «JOURNAL OF ORGANIC CHEMISTRY», 2015, 80, pp. 2216 - 2222 [Scientific article]