Sfoglia per Autore
Structural and spectroscopic characterization of fluorinated dioxole based salts: a combined experimental and computational study
2013-01-01 Milani, Alberto; Castiglioni, Chiara; S., Radice; G., Canil; M., Bassi; M., Galimberti
Polymorphism of Poly(butylene terephthalate) Investigated by Means of Periodic Density Functional Theory Calculations
2014-01-01 Milani, Alberto; Galimberti, DARIA RUTH
A revisitation of the polymorphism of poly(butylene-2,6-naphthalate) from periodic first-principles calculations
2014-01-01 Milani, Alberto
Crystal Structure and Vibrational Spectra of Poly(trimethylene terephthalate) from Periodic Density Functional Theory Calculations
2014-01-01 Galimberti, DARIA RUTH; Milani, Alberto
π-Conjugation and Endgroup Effects in Long Cumulenes: Raman Spectroscopy and DFT Calculations
2014-01-01 Tommasini, MATTEO MARIA SAVERIO; Milani, Alberto; Fazzi, Daniele; Lucotti, Andrea; Castiglioni, Chiara; J. A., Januszewski; D., Wendinger; R. R., Tykwinski
Chemical modification of Hyflon® AD copolymer end groups by means of physical and chemical treatments. A joint spectroscopic and quantum chemical investigation
2015-01-01 Stefano, Radice; Giorgio, Canil; Stefano, Millefanti; Vito, Tortelli; Milani, Alberto; Castiglioni, Chiara
Polymorphism of even nylons revisited through periodic quantum chemical calculations
2015-01-01 Galimberti, DARIA RUTH; Quarti, Claudio; Milani, Alberto
Joint Experimental and Computational Investigation of the Structural and Spectroscopic Properties of Poly(vinylidene fluoride) Polymorphs
2015-01-01 Milani, Alberto; Castiglioni, Chiara; Radice, Stefano
Unpolarized and Polarized Raman Spectroscopy of Nylon-6 Polymorphs: A Quantum Chemical Approach
2015-01-01 Milani, Alberto
Raman spectroscopy as a tool to investigate the structure and electronic properties of carbon-atom wires
2015-01-01 Milani, Alberto; Tommasini, MATTEO MARIA SAVERIO; Russo, Valeria; LI BASSI, Andrea; Lucotti, Andrea; F., Cataldo; Casari, CARLO SPARTACO
Carbon-atom wires: 1-D systems with tunable properties
2016-01-01 Casari, CARLO SPARTACO; Tommasini, MATTEO MARIA SAVERIO; Tykwinski, R. R.; Milani, Alberto
Vibrational Response of Methylammonium Lead Iodide: From Cation Dynamics to Phonon–Phonon Interactions
2016-01-01 Ivanovska, Tanja; Quarti, Claudio; Grancini, Giulia; Petrozza, Annamaria; De Angelis, Filippo; Milani, Alberto; Ruani, Giampiero
Intermolecular modulation of IR intensities in the solid state. the role of weak interactions in polyethylene crystal: A computational DFT study
2016-01-01 Galimberti, DARIA RUTH; Milani, Alberto; Maschio, Lorenzo; Castiglioni, Chiara
Domino reaction for the controlled functionalization of sp2 carbon allotropes
2017-01-01 Barbera, V.; Milani, A.; Brambilla, L.; Castiglioni, C.; Galimberti, M.
Static vs dynamic DFT prediction of IR spectra of flexible molecules in the condensed phase: The (ClCF2CF(CF3)OCF2CH3) liquid as a test case
2017-01-01 Galimberti, Daria Ruth; Milani, Alberto; Gaigeot, MARIE-PIERRE; Radice, Stefano; Tonelli, Claudio; Picozzi, Rosaldo; Castiglioni, Chiara
Combining Static and Dynamical Approaches for Infrared Spectra Calculations of Gas Phase Molecules and Clusters
2017-01-01 Galimberti, Daria R.; Milani, Alberto; Tommasini, Matteo; Castiglioni, Chiara; Gaigeot, Marie-Pierre
Semiconductor-to-Metal Transition in Carbon-Atom Wires Driven by sp2 Conjugated End Groups
2017-01-01 Milani, Alberto; Tommasini, MATTEO MARIA SAVERIO; Barbieri, Valentino; Lucotti, Andrea; Russo, Valeria; Cataldo, Franco; Casari, CARLO SPARTACO
Strain-dependent vibrational spectra and elastic modulus of poly(p-phenylene terephtalamide) from first-principles calculations
2017-01-01 Avanzini, Lorenzo; Brambilla, Luigi; Marano, Claudia; Milani, Alberto
Bottom-Up Synthesis of Heteroatom-Doped Chiral Graphene Nanoribbons
2018-01-01 Wang, X. Y.; Urgel, J. I.; Borin Barin, G.; Eimre, K.; Di Giovannantonio, M.; Milani, A.; Tommasini, M.; Pignedoli, C. A.; Ruffieux, P.; Feng, X.; Fasel, R.; Müllen, K.; Narita, A.
Copper-surface-mediated synthesis of acetylenic carbon-rich nanofibers for active metal-free photocathodes
2018-01-01 Zhang, Tao; Hou, Yang; Dzhagan, Volodymyr; Liao, Zhongquan; Chai, Guoliang; Löffler, Markus; Olianas, Davide; Milani, Alberto; Xu, Shunqi; Tommasini, Matteo; Zahn, Dietrich R. T.; Zheng, Zhikun; Zschech, Ehrenfried; Jordan, Rainer; Feng, Xinliang
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