D'AMORE, MADDALENA

D'AMORE, MADDALENA  

CHIMICA  

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Risultati 1 - 20 di 24 (tempo di esecuzione: 0.035 secondi).
Titolo Data di pubblicazione Autore(i) File
Characterization and Modeling of Reversible CO2 Capture from Wet Streams by a MgO/Zeolite Y Nanocomposite 2019 Signorile, Matteo; Vitillo, Jenny G.; D’Amore, Maddalena; Crocellà, Valentina; Ricchiardi, Gabriele; Bordiga, Silvia
Characterization of the negatively charged NV defect through the spin density distribution and the hyperfine coupling constants 2022 Ferrari A.M.; El-Kelany K.E.; Gentile F.S.; D'Amore M.; Romeo E.; Dovesi R.
Computational Characterization of β-Li3PS4 Solid Electrolyte: From Bulk and Surfaces to Nanocrystals 2022 Marana, Naiara Leticia; Sgroi, Mauro Francesco; Maschio, Lorenzo; Ferrari, Anna Maria; D'Amore, Maddalena; Casassa, Silvia
Computational Understanding of Delithiation, Overlithiation, and Transport Properties in Disordered Cubic Rock-Salt Type Li2TiS3 2023 Rocca, Riccardo; Sgroi, Mauro Francesco; D’amore, Maddalena; Li Pira, Nello; Ferrari, Anna Maria
Disordered Rock-Salt Type Li2TiS3 as Novel Cathode for LIBs: A Computational Point of View 2022 Rocca R.; Sgroi M.F.; Camino B.; D'amore M.; Ferrari A.M.
Effect of Internal Donors on Raman and IR Spectroscopic Fingerprints of MgCl2/TiCl4 Nanoclusters Determined by Machine Learning and DFT 2022 D’Amore, Maddalena; Taniike, Toshiaki; Terano, Minoru; Ferrari, Anna Maria
Elucidating the Interaction of CO2 in the Giant Metal-Organic Framework MIL-100 through Large-Scale Periodic Ab Initio Modeling 2019 D'Amore M.; Civalleri B.; Bush I.J.; Albanese E.; Ferrabone M.
From symmetry breaking in the bulk to phase transitions at the surface: a quantum-mechanical exploration of Li6PS5Cl argyrodite superionic conductor 2022 D'Amore, Maddalena; Daga, Loredana Edith; Rocca, Riccardo; Sgroi, Mauro Francesco; Marana, Naiara Leticia; Casassa, Silvia Maria; Maschio, Lorenzo; Ferrari, Anna Maria
Inelastic Neutron Scattering Investigation of MgCl2Nanoparticle-Based Ziegler-Natta Catalysts for Olefin Polymerization 2020 D'Amore M.; Piovano A.; Vottero E.; Piovano A.; Rudic S.; Erba A.; Groppo E.; Civalleri B.
Nitrogen substitutional defects in silicon. A quantum mechanical investigation of the structural, electronic and vibrational properties 2019 Platonenko A.; Gentile F.S.; Pascale F.; Ferrari A.M.; D'Amore M.; Dovesi R.
On the Structure of Superbasic (MgO)n sites solvated in a Faujasite Zeolite 2018 Vitillo, Jenny Grazia; Fjermestad, Torstein; D'Amore, Maddalena; Milanesio, Marco; Palin, Luca; Ricchiardi, Gabriele; Bordiga, Silvia
Probing the Coordinative Unsaturation and Local Environment of Ti3+ Sites in an Activated High-Yield Ziegler-Natta Catalyst 2015 Morra, Elena; Giamello, Elio; Van Doorslaer, Sabine; Antinucci, Giuseppe; D'Amore, Maddalena; Busico, Vincenzo; Chiesa, Mario
Quasi-Hexagonal to Lepidocrocite-like Transition in TiO2Ultrathin Films on Cu(001) 2021 Sorrentino A.L.; Serrano G.; Poggini L.; Cortigiani B.; El-Kelany K.E.; D'Amore M.; Ferrari A.M.; Atrei A.; Caneschi A.; Sessoli R.; Mannini M.
Revisiting the identity of δ-MgCl2: Part I. Structural disorder studied by synchrotron X-ray total scattering 2020 Wada T.; Takasao G.; Piovano A.; D'Amore M.; Thakur A.; Chammingkwan P.; Bruzzese P.C.; Terano M.; Civalleri B.; Bordiga S.; Groppo E.; Taniike T.
Revisiting the identity of δ-MgCl2: Part II. Morphology and exposed surfaces studied by vibrational spectroscopies and DFT calculation 2020 Piovano, Alessandro; D'Amore, Maddalena; Wada, Toru; Cleto Bruzzese, Paolo; Takasao, Gentoku; Thakur, Ashutosh; Chammingkwan, Patchanee; Terano, Minoru; Civalleri, Bartolomeo; Bordiga, Silvia; Taniike, Toshiaki; Groppo, Elena
Spectroscopic Evidences for TiCl4/Donor Complexes on the Surface of MgCl2-Supported Ziegler-Natta Catalysts 2018 Piovano, Alessandro; D'Amore, Maddalena*; Thushara, K.S.; Groppo, Elena
Spectroscopic Fingerprints of MgCl2/TiCl4Nanoclusters Determined by Machine Learning and DFT 2021 D'amore M.; Takasao G.; Chikuma H.; Wada T.; Taniike T.; Pascale F.; Ferrari A.M.
Stability and Formation of the Li3PS4/Li, Li3PS4/Li2S, and Li2S/Li Interfaces: A Theoretical Study 2023 Marana, Naiara Leticia; Casassa, Silvia; Sgroi, Mauro Francesco; Maschio, Lorenzo; Silveri, Fabrizio; D’Amore, Maddalena; Ferrari, Anna Maria
Substitutional boron and nitrogen pairs in diamond. A quantum mechanical vibrational analysis 2019 Salustro S.; Colasuonno F.; Ferrari A.M.; D'Amore M.; Mackrodt W.C.; Dovesi R.
Surface Investigation and Morphological Analysis of Structurally Disordered MgCl2 and MgCl2/TiCl4 Ziegler-Natta Catalysts 2016 D'Amore, Maddalena; Thushara, K.S.; Piovano, Alessandro; Causà, Mauro; Bordiga, Silvia; Groppo, Elena