フォロー
Simone Casolo
Simone Casolo
Cognite
確認したメール アドレス: cognite.com - ホームページ
タイトル
引用先
引用先
Understanding adsorption of hydrogen atoms on graphene
S Casolo, OM Løvvik, R Martinazzo, GF Tantardini
The Journal of chemical physics 130 (5), 2009
4072009
Atomic-scale characterization of nitrogen-doped graphite: Effects of dopant nitrogen on the local electronic structure of the surrounding carbon atoms
T Kondo, S Casolo, T Suzuki, T Shikano, M Sakurai, Y Harada, M Saito, ...
Physical review B 86 (3), 035436, 2012
2922012
Symmetry-induced band-gap opening in graphene superlattices
R Martinazzo, S Casolo, GF Tantardini
Physical Review B 81 (24), 245420, 2010
1222010
Band engineering in graphene with superlattices of substitutional defects
S Casolo, R Martinazzo, GF Tantardini
The Journal of Physical Chemistry C 115 (8), 3250-3256, 2011
1052011
Density functional theory based screening of ternary alkali-transition metal borohydrides: A computational material design project
JS Hummelshøj, DD Landis, J Voss, T Jiang, A Tekin, N Bork, M Dułak, ...
The Journal of chemical physics 131 (1), 2009
842009
Inherently chiral macrocyclic oligothiophenes: easily accessible electrosensitive cavities with outstanding enantioselection performances
F Sannicolò, PR Mussini, T Benincori, R Cirilli, S Abbate, S Arnaboldi, ...
Chemistry–A European Journal 20 (47), 15298-15302, 2014
722014
A few simple rules governing hydrogenation of graphene dots
M Bonfanti, S Casolo, GF Tantardini, A Ponti, R Martinazzo
The Journal of chemical physics 135 (16), 2011
452011
Structure and stability of hydrogenated carbon atom vacancies in graphene
M Casartelli, S Casolo, GF Tantardini, R Martinazzo
Carbon 77, 165-174, 2014
392014
Spin coupling around a carbon atom vacancy in graphene
M Casartelli, S Casolo, GF Tantardini, R Martinazzo
Physical Review B 88 (19), 195424, 2013
392013
Surface Temperature Effects on Dissociative Chemisorption of H2 on Cu(100)
A Marashdeh, S Casolo, L Sementa, H Zacharias, GJ Kroes
The Journal of Physical Chemistry C 117 (17), 8851-8863, 2013
392013
Insights into H2 formation in space from ab initio molecular dynamics
S Casolo, GF Tantardini, R Martinazzo
Proceedings of the National Academy of Sciences 110 (17), 6674-6677, 2013
382013
Inherently Chiral Spider‐Like Oligothiophenes
F Sannicolò, PR Mussini, T Benincori, R Martinazzo, S Arnaboldi, ...
Chemistry–A European Journal 22 (31), 10839-10847, 2016
342016
Oxygen Nonstoichiometry in (Ca2CoO3)0.62(CoO2): A Combined Experimental and Computational Study
M Schrade, S Casolo, PJ Graham, C Ulrich, S Li, OM Løvvik, TG Finstad, ...
The Journal of Physical Chemistry C 118 (33), 18899-18907, 2014
312014
Quantum Dynamics of the Eley− Rideal Hydrogen Formation Reaction on Graphite at Typical Interstellar Cloud Conditions
S Casolo, R Martinazzo, M Bonfanti, GF Tantardini
The Journal of Physical Chemistry A 113 (52), 14545-14553, 2009
292009
Surface models and reaction barrier in Eley–Rideal formation of H 2 on graphitic surfaces
M Bonfanti, S Casolo, GF Tantardini, R Martinazzo
Physical Chemistry Chemical Physics 13 (37), 16680-16688, 2011
282011
Role of the self-interaction error in studying chemisorption on graphene from first-principles
S Casolo, E Flage-Larsen, OM Løvvik, GR Darling, GF Tantardini
Physical Review B 81 (20), 205412, 2010
272010
Theoretical analysis of oxygen vacancies in layered sodium cobaltate, NaxCoO2− δ
S Casolo, OM Løvvik, H Fjeld, T Norby
Journal of Physics: Condensed Matter 24 (47), 475505, 2012
222012
Hydrogen recombination and dimer formation on graphite from ab initio molecular dynamics simulations
S Casolo, GF Tantardini, R Martinazzo
The Journal of Physical Chemistry A 120 (27), 5032-5040, 2016
122016
Physics and applications of graphene–theory
R Martinazzo, S Casolo, GF Tantardini
InTech, Rijeka, Croatia, 2011
102011
The effect of atomic-scale defects and dopants on graphene electronic structure
R Martinazzo, S Casolo, GF Tantardini
Physics and Applications of Graphene-Theory, 2011
72011
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