Sfoglia per Autore
2,3-EXO-DISYNDIOTACTIC POLYNORBORNENE: A CRYSTALLINE POLYMER WITH TUBULAR HELICAL MOLECULAR STRUCTURE
2012-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO
Unexpected Inversion in Preferential Stability of Gauche Over Anti Conformers of Alkylaromatics’Side Chains
2012-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO; Raos, Guido
A Solid State Density Functional Study of Crystalline Thiophene-Based Oligomers and Polymers
2012-01-01 Famulari, Antonino; Raos, Guido; Baggioli, Alberto; Casalegno, Mose'; Riccardo, Po; Meille, STEFANO VALDO
Organic Peracids: A Structural Puzzle for 17O NMR and Ab InitioChemical Shift Calculations
2012-01-01 Castiglione, Franca; Baggioli, Alberto; Citterio, Attilio; Mele, Andrea; Raos, Guido
Materials for organic photovoltaics: insights from detailed structural models and molecular simulations
2012-01-01 Casalegno, Mose'; Baggioli, Alberto; Famulari, Antonino; Meille, STEFANO VALDO; Nicolini, Tommaso; R., Po; Raos, Guido
The structure of 2,3-exo-disyndiotactic polynorbornene: a combined X-ray diffraction / molecular modelling study
2013-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO
Regioregular Poly(3-octylthiophene): Diffraction studies and computational modeling
2013-01-01 Nicolini, Tommaso; Raos, Guido; Baggioli, Alberto; Casalegno, Mose'; Famulari, Antonino; Martin, Brinkmann; Meille, STEFANO VALDO
Computational 17O-NMR spectroscopy of organic acids and peracids: comparison of solvation models
2013-01-01 Baggioli, Alberto; O., Crescenzi; M. J., Field; Castiglione, Franca; Raos, Guido
Intramolecular CH/π interactions in alkylaromatics: Monomer conformations for poly(3-alkylthiophene) atomistic models
2013-01-01 Baggioli, Alberto; Meille, STEFANO VALDO; Raos, Guido; Riccardo, Po; Martin, Brinkmann; Famulari, Antonino
Monomer conformations for poly(3-alkylthiophene) atomistic models
2013-01-01 Famulari, Antonino; Baggioli, Alberto; Raos, Guido; Meille, STEFANO VALDO
Unusual crystallization mode of tubular helical 2,3-exo-disyndiotactic polynorbornene: a combined X ray diffraction / molecular modelling study
2014-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO
A Molecular Modelling Study of 2,3-exo-disyndiotactic Polynorbornene
2014-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO
Unusual crystallization mode of tubular helical 2,3- exo-disyndiotactic polynorbornene
2014-01-01 Famulari, Antonino; Baggioli, Alberto; Meille, STEFANO VALDO
On the inter-ring torsion potential of regioregular P3HT: a first principles reexamination with explicit side chains
2014-01-01 Baggioli, Alberto; Famulari, Antonino
Free-radical selective functionalization of 1,4-naphthoquinones by perfluorodiacyl peroxides
2014-01-01 Sansotera, Maurizio; Gambarotti, Cristian; Famulari, Antonino; Baggioli, Alberto; R., Soave; Venturini, Francesco; Meille, STEFANO VALDO; I., Wlassics; Navarrini, WALTER MAURIZIO
Exploring short intramolecular interactions in alkylaromatic substrates
2016-01-01 Baggioli, Alberto; Cavallotti, CARLO ALESSANDRO; Famulari, Antonino
Nucleophilicity and electrophilicity of the C(sp(3))-H bond: methane and ethane binary complexes with iodine
2017-01-01 Baggioli, Alberto; Meille, STEFANO VALDO; Famulari, Antonino
Can a whole nanoparticle accurately describe a single C60 fullerene when it comes to weak electrostatic interactions?
2018-01-01 Baggioli, Alberto; Famulari, Antonino
Thermodynamics of aqueous perfluorooctanoic acid (PFOA) and 4,8-dioxa-3H-perfluorononanoic acid (DONA) from DFT calculations: Insights into degradation initiation
2018-01-01 Baggioli, Alberto; Sansotera, Maurizio; Navarrini, Walter
Catalytic microreactor with electrodeposited hierarchically nanostructured nickel coatings for gas-phase fluorination reactions
2018-01-01 Sansotera, Maurizio; Baggioli, Alberto; Ieffa, Simona; Tedesco, Mariella; Sacchi, Benedetta; Bianchi, Claudia L.; Navarrini, Michele; Migliori, Massimo; Magagnin, Luca; Navarrini, Walter
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