Search Results - "Mulas, G"

Electronic and optical properties of families of polycyclic aromatic hydrocarbons: A systematic (time-dependent) density functional theory study by Malloci, G., Cappellini, G., Mulas, G., Mattoni, A.

“…Electronic absorption spectra of the neutral molecules of the four PAH classes considered, as computed using the real-time real-space TD-DFT. [Display omitted]…”
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Ternary Sn–Co–C Li-ion battery electrode material prepared by high energy ball milling by Hassoun, J., Mulas, G., Panero, S., Scrosati, B.

“…The recent announcement of the launch in the market of a new type of lithium-ion battery has instilled new life in the R&D of innovative electrode materials…”
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Time-dependent density functional study of the electronic spectra of oligoacenes in the charge states −1, 0, +1, and +2 by Malloci, G., Mulas, G., Cappellini, G., Joblin, C.

“…We present a systematic theoretical study of the five smallest oligoacenes (naphthalene, anthracene, tetracene, pentacene, and hexacene) in their anionic,…”
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An electrochemical investigation of a Sn–Co–C ternary alloy as a negative electrode in Li-ion batteries by Hassoun, J., Panero, S., Mulas, G., Scrosati, B.

“…This work reports an electrochemical investigation of a Sn–Co–C ternary electrode which supposedly is similar to that adopted in a new lithium-ion commercial…”
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A new magnetic resonance imaging approach for discriminating Sardinian sheep milk cheese made from heat-treated or raw milk by Mulas, G, Roggio, T, Uzzau, S, Anedda, R

“…The evaluation of milk heat treatment on dairy products via reliable analytical methods is a challenging issue that involves both industrial and fundamental…”
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Neuroprotective and anti-inflammatory properties of a novel non-thiazolidinedione PPARγ agonist in vitro and in MPTP-treated mice by Lecca, D, Nevin, D.K, Mulas, G, Casu, M.A, Diana, A, Rossi, D, Sacchetti, G, Carta, A.R

“…Highlights • MDG548 is a novel highly selective PPAR-gamma agonist. • MDG548 is protective against H2 O2 and MPP+ in cultured neurons. • MDG548 inhibits NF-kB…”
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A (time-dependent) density functional theory study of the optoelectronic properties of bis-triisopropylsilylethynyl-functionalized acenes by Malloci, G., Cappellini, G., Mulas, G., Mattoni, A.

“…We report a comparative study of the optoelectronic properties of small acenes (benzene, anthracene, and pentacene) and their bis-triisopropylsilylethynyl…”
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Morphofunctional alterations in ventral tegmental area dopamine neurons in acute and prolonged opiates withdrawal. A computational perspective by Enrico, P, Migliore, M, Spiga, S, Mulas, G, Caboni, F, Diana, M

“…Highlights • Opiates withdrawal inhibits mesolimbic dopaminergic activity and dopamine release. • These effects can be described using a biophysically…”
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Redshifted diffuse interstellar bands in the Orion OB1 association by Krełowski, J., Galazutdinov, G. A., Mulas, G., Maszewska, M., Cecchi-Pestellini, C.

“…The wavelength displacements of the diffuse interstellar bands (DIBs) at 4502, 5705, 5780, 6284 and 7224 Å, with respect to the well-known, narrow…”
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Mechanical work and conversion degree in mechanically induced processes by Delogu, F., Mulas, G., Schiffini, L., Cocco, G.

“…Several mechanochemical reactions, involving the formation of amorphous phases and extended solid solutions as well as the spontaneous spreading of…”
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Understanding oscillatory phenomena in molecular hydrogen generation via sodium borohydride hydrolysis by Budroni, M A, Biosa, E, Garroni, S, Mulas, G R C, Marchettini, N, Culeddu, N, Rustici, M

“…The hydrolysis of borohydride salts represents one of the most promising processes for the generation of high purity molecular hydrogen under mild conditions…”
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Kinetics behaviour of metastable equiatomic Cu–Fe solid solution as function of the number of collisions induced by mechanical alloying by Contini, A., Delogu, F., Garroni, S., Mulas, G., Enzo, S.

“…•Cu–Fe powders were studied as a function of the number of hits during MA.•An impulsive model describes the kinetics curves of solid solution formation.•The…”
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Structural evolution upon decomposition of the LiAlH4+LiBH4 system by Soru, S., Taras, A., Pistidda, C., Milanese, C., Bonatto Minella, C., Masolo, E., Nolis, P., Baró, M.D., Marini, A., Tolkiehn, M., Dornheim, M., Enzo, S., Mulas, G., Garroni, S.

“…•The desorption mechanism of LiBH4+LiAlH4 was studied by in situ SR-PXD•The formation of unidentified intermediate was proved by experimental evidences.•This…”
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Hydrogen absorption processes in Mg2Ni-based systems : Thermal and mechanochemical kinetics by DELOGU, F, MULAS, G

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Ammonia-free infiltration of NaBH4 into highly-ordered mesoporous silica and carbon matrices for hydrogen storage by Peru, F., Garroni, S., Campesi, R., Milanese, C., Marini, A., Pellicer, E., Baró, M.D., Mulas, G.

“…► Highly ordered mesoporous SBA-15 and CMK3 matrices were prepared. ► Confinement of NaBH4 into SBA-15 and CMK3 was performed by NH3-free wet infiltration. ►…”
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Mechanochemical synthesis of NaBH4 starting from NaH–MgB2 reactive hydride composite system by Garroni, S., Minella, C. Bonatto, Pottmaier, D., Pistidda, C., Milanese, C., Marini, A., Enzo, S., Mulas, G., Dornheim, M., Baricco, M., Gutfleisch, O., Suriñach, S., Baró, M. Dolors

“…The present investigation focuses on a new synthesis route of NaBH4 starting from the 2NaH + MgB2 system subjected to mechanochemical activation under reactive…”
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Sorption properties of NaBH4/MH2 (M = Mg, Ti) powder systems by GARRONI, S, MILANESE, C, GIRELLA, A, MARINI, A, MULAS, G, MENENDEZ, E, PISTIDDA, C, DORNHEIM, M, SURINACH, S, BARO, M. D

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The effect of CoSn/CoSn2 phase ratio on the electrochemical behaviour of Sn40Co40C20 ternary alloy electrodes in lithium cells by HASSOUN, J, OCHAL, P, PANERO, S, MULAS, G, BONATTO MINELLA, C, SCROSATI, B

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Corrigendum to “Neuroprotective and anti-inflammatory properties of a novel non-thiazolidinedione PPARγ agonist in vitro and in MPTP-treated mice” [Neuroscience 302 (2015) 23–35] by Lecca, D, Nevin, D.K, Mulas, G, Casu, M.A, Diana, A, Rossi, D, Sacchetti, G, Fayne, D, Carta, A.R

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Modelling peculiar extinction curves by Zonca, A., Cecchi-Pestellini, C., Mulas, G., Malloci, G.

“…We investigate the remarkable variety of IR-through-UV extinction curves by modelling extinction profiles with core-mantle grains and a collection of single…”
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