Piero Ugliengo
Piero Ugliengo
Professor of Physical Chemistry, University of Torino
Verified email at unito.it - Homepage
TitleCited byYear
Theoretical study of van der Waals complexes at surface sites in comparison with the experiment
J Sauer, P Ugliengo, E Garrone, VR Saunders
Chemical Reviews 94 (7), 2095-2160, 1994
7511994
B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals
B Civalleri, CM Zicovich-Wilson, L Valenzano, P Ugliengo
CrystEngComm 10 (4), 405-410, 2008
5402008
Silica surface features and their role in the adsorption of biomolecules: computational modeling and experiments
A Rimola, D Costa, M Sodupe, JF Lambert, P Ugliengo
Chemical reviews 113 (6), 4216-4313, 2013
3622013
MOLDRAW: molecular graphics on a personal computer
P Ugliengo, D Viterbo, G Chiari
Zeitschrift für Kristallographie-Crystalline Materials 208 (1-2), 383-384, 1993
2711993
Intermolecular interaction energies in molecular crystals: comparison and agreement of localized Møller–Plesset 2, dispersion-corrected density functional, and classical …
L Maschio, B Civalleri, P Ugliengo, A Gavezzotti
The Journal of Physical Chemistry A 115 (41), 11179-11186, 2011
1512011
Periodic ab initio study of structural and vibrational features of hexagonal hydroxyapatite Ca 10 (PO 4) 6 (OH) 2
M Corno, C Busco, B Civalleri, P Ugliengo
Physical Chemistry Chemical Physics 8 (21), 2464-2472, 2006
1492006
Hydroxyls nests in defective silicalites and strained structures derived upon dehydroxylation: vibrational properties and theoretical modelling
S Bordiga, P Ugliengo, A Damin, C Lamberti, G Spoto, A Zecchina, ...
Topics in Catalysis 15 (1), 43-52, 2001
1422001
Vibration frequencies of Mg3Al2Si3O12 pyrope. An ab initio study with the CRYSTAL code
F Pascale, CM Zicovich-Wilson, R Orlando, C Roetti, P Ugliengo, ...
The Journal of Physical Chemistry B 109 (13), 6146-6152, 2005
1372005
Vibrational spectrum of brucite, Mg (OH) 2: a periodic ab initio quantum mechanical calculation including OH anharmonicity
F Pascale, S Tosoni, C Zicovich-Wilson, P Ugliengo, R Orlando, R Dovesi
Chemical Physics Letters 396 (4-6), 308-315, 2004
1362004
Realistic models of hydroxylated amorphous silica surfaces and MCM‐41 mesoporous material simulated by large‐scale periodic B3LYP calculations
P Ugliengo, M Sodupe, F Musso, IJ Bush, R Orlando, R Dovesi
Advanced Materials 20 (23), 4579-4583, 2008
1352008
Experimental and quantum chemical studies on the adsorption of carbon dioxide on alkali-metal-exchanged ZSM-5 zeolites
B Bonelli, B Civalleri, B Fubini, P Ugliengo, CO Areán, E Garrone
The Journal of Physical Chemistry B 104 (47), 10978-10988, 2000
1312000
Ab initio study of the adducts of carbon monoxide with alkaline cations
AM Ferrari, P Ugliengo, E Garrone
The Journal of chemical physics 105 (10), 4129-4139, 1996
1251996
Silanol as a model for the free hydroxyl of amorphous silica: ab-initio calculations of the interaction with water
P Ugliengo, V Saunders, E Garrone
Journal of Physical Chemistry 94 (6), 2260-2267, 1990
1121990
Hydroxyapatite as a key biomaterial: quantum-mechanical simulation of its surfaces in interaction with biomolecules
M Corno, A Rimola, V Bolis, P Ugliengo
Physical Chemistry Chemical Physics 12 (24), 6309-6329, 2010
1112010
Structural and induced heterogeneity at the surface of some silica polymorphs from the enthalpy of adsorption of various molecules
B Fubini, V Bolis, A Cavenago, E Garrone, P Ugliengo
Langmuir 9 (10), 2712-2720, 1993
1101993
Adsorption of NH3 and H2O in acidic chabazite. Comparison of ONIOM approach with periodic calculations
X Solans-Monfort, M Sodupe, V Branchadell, J Sauer, R Orlando, ...
The Journal of Physical Chemistry B 109 (8), 3539-3545, 2005
1082005
Ab initio modeling of protein/biomaterial interactions: glycine adsorption at hydroxyapatite surfaces
A Rimola, M Corno, CM Zicovich-Wilson, P Ugliengo
Journal of the American Chemical Society 130 (48), 16181-16183, 2008
992008
Interaction of glycine with isolated hydroxyl groups at the silica surface: First principles B3LYP periodic simulation
A Rimola, M Sodupe, S Tosoni, B Civalleri, P Ugliengo
Langmuir 22 (15), 6593-6604, 2006
992006
Can Cu+-Exchanged Zeolites Store Molecular Hydrogen? An Ab-Initio Periodic Study Compared with Low-Temperature FTIR
X Solans-Monfort, V Branchadell, M Sodupe, CM Zicovich-Wilson, ...
The Journal of Physical Chemistry B 108 (24), 8278-8286, 2004
962004
Affinity scale for the interaction of amino acids with silica surfaces
A Rimola, M Sodupe, P Ugliengo
The Journal of Physical Chemistry C 113 (14), 5741-5750, 2009
942009
The system can't perform the operation now. Try again later.
Articles 1–20