| The vibrational features of hydroxylapatite and type A carbonated apatite: a first principle contribution G Ulian, G Valdrè, M Corno, P Ugliengo American Mineralogist 98 (4), 752-759, 2013 | 62 | 2013 |
| Comparison between Gaussian-type orbitals and plane wave ab initio density functional theory modeling of layer silicates: Talc [Mg3Si4O10 (OH) 2] as model system G Ulian, S Tosoni, G Valdrè The Journal of chemical physics 139 (20), 2013 | 48 | 2013 |
| The compressional behaviour and the mechanical properties of talc [Mg3Si4O10(OH)2]: a density functional theory investigation G Ulian, S Tosoni, G Valdrè Physics and Chemistry of Minerals 41, 639-650, 2014 | 41 | 2014 |
| Periodic ab initio bulk investigation of hydroxylapatite and type A carbonated apatite with both pseudopotential and all-electron basis sets for calcium atoms G Ulian, G Valdrè, M Corno, P Ugliengo American Mineralogist 98 (2-3), 410-416, 2013 | 41 | 2013 |
| Density functional investigation of the thermophysical and thermochemical properties of talc [Mg3Si4O10(OH)2] G Ulian, G Valdrè Physics and Chemistry of Minerals 42, 151-162, 2015 | 40 | 2015 |
| Raman spectroscopic investigation on the molecular structure of apatite and collagen in osteoporotic cortical bone G Pezzotti, A Rondinella, E Marin, W Zhu, NN Aldini, G Ulian, G Valdrè Journal of the mechanical behavior of biomedical materials 65, 264-273, 2017 | 38 | 2017 |
| Nanoscale cross-correlated AFM, Kelvin probe, elastic modulus and quantum mechanics investigation of clay mineral surfaces: The case of chlorite D Moro, G Ulian, G Valdrè Applied Clay Science 131, 175-181, 2016 | 38 | 2016 |
| Density functional investigation of the thermo-physical and thermo-chemical properties of 2M1 muscovite G Ulian, G Valdre American Mineralogist 100 (4), 935-944, 2015 | 38 | 2015 |
| DFT investigation of structural and vibrational properties of type B and mixed AB carbonated hydroxylapatite G Ulian, G Valdrè, M Corno, P Ugliengo American Mineralogist 99 (1), 117-127, 2014 | 38 | 2014 |
| Effects of fluorine content on the elastic behavior of topaz [Al2SiO4 (F, OH) 2] G Ulian, G Valdrè American Mineralogist 102 (2), 347-356, 2017 | 32 | 2017 |
| Structural, vibrational and thermophysical properties of pyrophyllite by semi-empirical density functional modelling G Ulian, G Valdrè Physics and Chemistry of Minerals 42, 609-627, 2015 | 32 | 2015 |
| First principle investigation of the mechanical properties of natural layered nanocomposite: Clinochlore as a model system for heterodesmic structures G Ulian, D Moro, G Valdre Composite Structures 202, 551-558, 2018 | 29 | 2018 |
| Single molecule investigation of glycine–chlorite interaction by cross-correlated scanning probe microscopy and quantum mechanics simulations D Moro, G Ulian, G Valdre Langmuir 31 (15), 4453-4463, 2015 | 26 | 2015 |
| First-principles study of structural and surface properties of (001) and (010) surfaces of hydroxylapatite and carbonated hydroxylapatite G Ulian, D Moro, G Valdre Journal of Applied Crystallography 49 (6), 1893-1903, 2016 | 25 | 2016 |
| Equation of state and second-order elastic constants of portlandite Ca(OH)2 and brucite Mg(OH)2 G Ulian, G Valdrè Physics and Chemistry of Minerals 46, 101-117, 2019 | 24 | 2019 |
| Second‐order elastic constants of hexagonal hydroxylapatite (P63) from ab initio quantum mechanics: Comparison between DFT functionals and basis sets G Ulian, G Valdre International Journal of Quantum Chemistry 118 (5), e25500, 2018 | 22 | 2018 |
| CO32– Mobility in Carbonate Apatite As Revealed by Density Functional Modeling F Peccati, M Corno, M Delle Piane, G Ulian, P Ugliengo, G Valdre The Journal of Physical Chemistry C 118 (2), 1364-1369, 2014 | 21 | 2014 |
| Hydroxylapatite and related minerals in bone and dental tissues: Structural, spectroscopic and mechanical properties from a computational perspective G Ulian, D Moro, G Valdrè Biomolecules 11 (5), 728, 2021 | 20 | 2021 |
| Benchmarking dispersion-corrected DFT methods for the evaluation of materials with anisotropic properties: structural, electronic, dielectric, optical and vibrational analysis … G Ulian, D Moro, G Valdre Physical Chemistry Chemical Physics 23 (34), 18899-18907, 2021 | 19 | 2021 |
| Infrared and Raman spectroscopic features of clinochlore Mg6Si4O10 (OH) 8: A density functional theory contribution G Ulian, D Moro, G Valdrè Applied Clay Science 197, 105779, 2020 | 18 | 2020 |
Marta CornoAssociate Professor Phys. Chem., PhD, Chemistry Department, University of Turin, ItalyVerified email at unito.it
