DEMOCRITOS UNESCO IAEA
List of publications
Last update: September 2011
G. Profeta and S. Scandolo
Far-infrared spectrum of ice Ih: A first-principles study
Phys. Rev. B 84, 024103 (2011) [PDF]

A. T. Raji, R. Mazzarello, S. Scandolo, S. Nsengiyumva, M. Haerting, and D. T. Britton
Intrinsic defects and krypton impurity atoms in hcp titanium: A first-principles study
Phys. Rev. B 83, 054120 (2011) [PDF]

Y. Liang, F. Ogundare, C. R. Miranda, J. Christie, and S. Scandolo
Structural properties and phase transitions in a silica clathrate
J. Chem. Phys. 134, 074506 (2011) [PDF]

L. Giacomazzi, P. Carrez, S. Scandolo, and P. Cordier
Dislocation properties of coesite from an ab-initio parametrized interatomic potential
Phys. Rev. B 83, 014110 (2011) [PDF]

Mal-Soon Lee and S. Scandolo
Mixtures of planetary ices at extreme conditions
Nature Comm. 2, 185 (2011) [PDF]

L. Fontana, M. Santoro, R. Bini, Diep Q. Vinh, and S. Scandolo
High-pressure vibrational properties of polyethylene
J. Chem. Phys. 133, 204502 (2010) [PDF]

N. Chetty, R.M. Martin, S. Scandolo
Material progress in Africa
Nature Phys. 6, 830 (2010) [Link to article]

S. K. Bhattacharya, J.M. Finn, Vinh P. Diep, F. Baletto, and S. Scandolo
CCl4 dissociation on the ice I-h surface: an excess electron mediated process
Phys. Chem. Chem. Phys. 12, 13034 (2010) [PDF]

X. J. Han, L. Bergqvist, P. H. Dederichs, H. Mueller-Krumbhaar, J. Christie, S. Scandolo, and P. Tangney
Polarizable interatomic force field for TiO2 parametrized using density functional theory
Phys. Rev. B 81, 134108 (2010) [PDF]

L. Giacomazzi and S. Scandolo
Gypsum under pressure: A first-principles study
Phys. Rev. B 81, 064103 (2010) [PDF]

P. Tangney and S. Scandolo
Melting slope of MgO from molecular dynamics and density functional theory
J. Chem. Phys. 131, 124510 (2009) [PDF]

G.A. Adebayo, Y. Liang, C.R. Miranda, and S. Scandolo
Infrared absorption of MgO at high pressures and temperatures: A molecular dynamic study
J. Chem. Phys. 131, 014506 (2009) [PDF]

P. Giannozzi et al.
Quantum ESPRESSO: a Modular and Open-Source Software Project for Quantum Simulations of Materials
J. Phys.: Condens. Matter 21, 395502 (2009) [PDF]

A. T. Raji, S. Scandolo, R. Mazzarello, S. Nsengiyumva, M. Haerting, and D. T. Britton
Ab Initio Study of Krypton in HCP Ti: Diffusion, Formation, and Stability of Small Krypton-Vacancy Clusters
Nucl. Instr. and Meth. B 267, 2991 (2009) [PDF]

A. T. Raji, S. Scandolo, R. Mazzarello, S. Nsengiyumva, M. Haerting, and D. T. Britton
Ab initio Pseudopotential Study of Vacancies and Self-interstitials in HCP Titanium
Philos. Mag. 89, 1629 (2009) [PDF]

M.-S. Lee, J.A. Montoya, S. Scandolo
Thermodynamic stability of layered structures in compressed CO2
Phys. Rev. B, 79, 144102 (2009) [PDF]

J. Sun, D.D. Klug, R. Martonak, J.A. Montoya, M.-S. Lee, S. Scandolo, E. Tosatti
High-pressure polymeric phases of carbon dioxide
Proc. Natl. Acad. Sci. USA, 106, 6077 (2009) [PDF]

U. Bovensiepen, C. Gahl, J. Staehler, M. Bockstedte, M. Meyer, F. Baletto, S. Scandolo, X.-Y. Zhu, A. Rubio, M. Wolf
A dynamic landscape from femtoseconds to minutes for excess electrons at ice/metal interfaces
J. Phys. Chem. C 113, 979 (2009) [PDF]

T. Anh Pham, R. Gebauer, S. Scandolo
Magnetism and vibrations in the phase epsilon of oxygen
Solid St. Comm. 149, 160 (2009) [PDF]

A. Cossaro, R. Mazzarello, R. Rousseau, L. Casalis, A. Verdini, A. Kohlmeyer, L. Floreano, S. Scandolo, A. Morgante, M.L. Klein, G. Scoles
X-ray diffraction and computation yield the structure of alkanethiols on gold(111)
Science 321, 943 (2008) [abstract]

Mal-Soon Lee, F. Baletto, D.G. Kanhere, and S. Scandolo
Far-infrared absorption of water clusters by first-principle molecular dynamics
J. Chem. Phys. 128, 214506 (2008) [PDF]

Y. Liang, C.R. Miranda, and S. Scandolo
Temperature-induced densification of compressed SiO2 glass: A molecular dynamics study
High Press. Res. 28, 35 (2008) [PDF]

J.A. Montoya, R. Rousseau, M. Santoro, F. Gorelli, and S. Scandolo
Mixed threefold and fourfold carbon coordination in compressed CO2
Phys. Rev. Lett. 100, 163002 (2008) [PDF]

A.D. Hernandez, J.A. Montoya, G. Profeta, S. Scandolo
First-principles investigation of the electron-phonon interaction in OsN2: Theoretical prediction of superconductivity mediated by N-N covalent bonds
Phys. Rev. B 77, 092504 (2008) [PDF]

U. F. T. Ndongmouo, M.-S. Lee, R. Rousseau, F. Baletto, and S. Scandolo
Finite-Temperature Effects on the Stability and Infrared Spectra of HCl(H2O)6 Clusters
J. Phys. Chem. A 111, 12810 (2007) [PDF]

Y. Liang, C.R. Miranda, and S. Scandolo
Mechanical strength and coordination defects in compressed silica glass: molecular dynamics simulations
Phys. Rev. B 75, 024205 (2007) [PDF]

Y. Liang, C.R. Miranda, and S. Scandolo
Tuning oxygen packing in silica by non-hydrostatic pressure
Phys. Rev. Lett. 99, 215504 (2007) [PDF]

O. Degtyareva, M. V. Magnitskaya, J. Kohanoff, G. Profeta, S. Scandolo, M. Hanfland, M. I. McMahon, and E. Gregoryanz
Competition of Charge-Density Waves and Superconductivity in Sulfur
Phys. Rev. Lett. 99, 155505 (2007) [PDF]

A. Aravindh et al.
Si{x}C{1-x}O2 alloys: A possible route to stabilize carbon-based silica-like solids?
Solid St. Comm. 144, 273 (2007) [PDF]

L. Fontana, Diep Q. Vinh, M. Santoro, S. Scandolo, F. A. Gorelli, R. Bini, and M. Hanfland
High-pressure crystalline polyethylene studied by x-ray diffraction and ab initio simulations
Phys. Rev. B 75, 174112 (2007) [PDF]

R. Mazzarello, A. Cossaro, A. Verdini, R. Rousseau, L. Casalis, M. F. Danisman, L. Floreano, S. Scandolo, A. Morgante, and G. Scoles
Structure of a CH3S Monolayer on Au(111) solved by the Interplay Between Molecular Dynamics Calculations and Diffraction Measurements
Phys. Rev. Lett. 98, 016102 (2007) [PDF]

J.A. Montoya, A.D. Hernandez, C. Sanloup, E. Gregoryanz, and S. Scandolo
OsN2: crystal structure and electronic properties
Appl. Phys. Lett. 90, 011909 (2007) [PDF]

J.T.K. Wan, T.S. Duffy, S. Scandolo, and R. Car
First-principles study of density, viscosity, and diffusion coefficients of liquid MgSiO3 at conditions of the Earth's deep mantle
J. Geophys. Res. 112, B03208 (2007) [PDF]

Y. Liang, C.R. Miranda, and S. Scandolo
Infrared and Raman spectra of silica polymorphs from an ab initio parametrized polarizable force field
J. Chem. Phys. 125, 194524 (2006) [PDF]

C. R. Miranda, K. V. Tretiakov and S. Scandolo
A computational study of elastic properties of disordered systems with voids
J. Non-Cryst. Solids, 352, 4283 (2006) [PDF]

S. Scandolo
La simulazione a principi primi esplora il cuore dei pianeti
Il Nuovo Saggiatore 22 (3-4), 55-64 (2006)

M. Santoro, F.A. Gorelli, R. Bini, G. Ruocco, S. Scandolo, and W.A. Crichton
Amorphous silica-like carbon dioxide
Nature 441, 857 (2006) [link to article], [link to N&V]

R. Rousseau, V. De Renzi, R. Mazzarello, D. Marchetto, R. Biagi, S. Scandolo, and U. del Pennino
Interfacial electrostatics of self-assembled monolayers of alkane thiolates on Au(111): Work function modification and molecular level alignments
J. Phys. Chem. B 110, 10862 (2006) [PDF]

A.F. Young, C. Sanloup, E. Gregoryanz, S. Scandolo, R.J. Hemley, and H.-k. Mao
Synthesis of novel transition metal nitrides IrN2 and OsN2
Phys. Rev. Lett. 96, 155501 (2006) [PDF]

A.F. Young, J.A. Montoya, C. Sanloup, M. Lazzeri, E. Gregoryanz, and S. Scandolo
Interstitial dinitrogen makes PtN2 an insulating hard solid
Phys. Rev. B 73, 153102 (2006) [PDF]

F. Baletto, C. Cavazzoni, S. Scandolo
Surface-trapped excess electrons on ice
Phys. Rev. Lett., 95, 176801 (2005) [PDF]

X. Wang, S. Scandolo, R. Car
Carbon phase diagram from ab-initio molecular dynamics
Phys. Rev. Lett., 95, 185701 (2005) [PDF]

R. Rousseau, R. Mazzarello, S. Scandolo
An Effective Pseudopotential for Modeling Gold Surface Slabs for Ab Initio Simulations
Chem. Phys. Chem. 6, 1756 (2005) [PDF]

F. Tassone, G.L. Chiarotti, R. Rousseau, S. Scandolo, and E. Tosatti
Dimerization of CO2 at high pressure and temperature
Chem. Phys. Chem. 6, 1752 (2005) [PDF]

V. De Renzi, R. Rousseau, D. Marchetto, R. Biagi, S. Scandolo, and U. del Pennino
Metal Work-Function Changes Induced by Organic Adsorbates: A Combined Experimental and Theoretical Study
Phys. Rev. Lett. 95, 046804 (2005) [PDF]

Balázs Hetényi, Sandro Scandolo, and Erio Tosatti
Orientational ordering of ortho-para mixtures of crystals of homonuclear diatomic molecules: Theoretical evidence for reentrance
J. Low Temp. Phys. 139, 753 (2005) [PDF]

D. Ceresoli, M.C. Righi, E. Tosatti, S. Scandolo, G. Santoro, and S. Serra
Excitons self-trapping in bulk polyethylene
J. Phys.: Cond. Matt. 17, 4621 (2005) [PDF]

C. R. Miranda and S. Scandolo,
Computational materials science meets geophysics: dislocations and slip planes of MgO
Comp. Phys. Comm. 169, 24 (2005) [PDF]

A. Oganov, G.D. Price, S. Scandolo
Ab-initio theory of planetary materials
Z. Krist. 220, 531 (2005) [PDF] [link to publisher]

S. Scandolo, P. Giannozzi, C. Cavazzoni, S. de Gironcoli, A. Pasquarello, S. Baroni
First-principles codes for computational crystallography in the ``Quantum-ESPRESSO'' package
Z. Krist. 220, 574 (2005) [PDF] [link to publisher]

Balázs Hetényi, Sandro Scandolo, and Erio Tosatti
Theoretical Evidence for a Reentrant Phase Diagram in Ortho-Para Mixtures of Solid H2 at High Pressure
Phys. Rev. Lett. 94, 125503 (2005) [PDF]

S. Scandolo and G.E. Santoro
Back to square one for superfluidity
Physics World, December 2004, pp. 18-19
 
K. V. Tretiakov and S. Scandolo
Thermal conductivity of solid argon at high pressure and high temperature: a molecular dynamics study
J. Chem. Phys. , 121, 11177 (2004) [PDF]

D. Ceresoli, E. Tosatti, S. Scandolo, G. Santoro, and S. Serra
Trapping of excitons at chemical defects in polyethylene
J. Chem. Phys. 121, 6478 (2004) [PDF]

J. Tobik, A. Dal Corso, S. Scandolo, and E. Tosatti
Organic molecular crystals in electric fields
Surf. Sci. 566-568, 644 (2004) [PDF]

Y.-G. Yoon, R. Car, D. J. Srolovitz, and S. Scandolo
Thermal conductivity of crystalline quartz from classical simulations
Phys. Rev. B 70, 012302 (2004) [PDF]

K. V. Tretiakov and S. Scandolo
Thermal conductivity of solid argon from molecular dynamics simulations
J. Chem. Phys. 120, 3765 (2004) [PDF]

P. Tangney and S. Scandolo
A many-body interatomic potential for ionic systems: Application to MgO
J. Chem. Phys. 119, 9673 (2003) [PDF]

S. Scandolo and R. Jeanloz
The Centers of Planets
American Scientist 91, 516 (Nov-Dec 2003) [PDF]
> translated versions of this article have appeared in
. Investigación y Ciencia: Edición Espańola de Scientific American, (2004) Núm. 336, pages 6-16
. Le Scienze, Agosto 2004, n. 432, p. 46-55
. Pour la Science, n. 318 (2004)

S. Piccinin, A. Selloni, S. Scandolo, R. Car, and G. Scoles
Electronic properties of metal-molecule-metal systems at zero bias: A periodic density functional study
J. Chem. Phys. 119, 6729 (2003) [PDF]

S. Scandolo
Liquid-liquid phase transition in compressed hydrogen from first-principles simulations
Proc. Natl. Acad. Sci. USA, 100, 3051 (2003) [PDF]

S. Scandolo
First-principles molecular dynamics simulations at high pressure
Proc. of the International School of Physics "E. Fermi" on "High Pressure Phenomena", Course CXLVII (IOS, Amsterdam; 2002) pp. 195-214 [PDF]

A. Trave, P. Tangney, S. Scandolo, A. Pasquarello, R. Car
Pressure-induced structural changes in liquid SiO2 from ab-initio simulations
Phys. Rev. Lett, 89, 245504 (2002) [PDF]

P. Tangney and S. Scandolo
An ab-initio parametrized interatomic force-field for silica
J. Chem. Phys. 117, 8898 (2002) [PDF]

S. Serra, S. Iarlori, E. Tosatti, S. Scandolo, M.C. Righi, G.E. Santoro
Self-trapping vs. non-trapping of electrons and holes in organic insulators: polyethylene
Chem. Phys. Lett. 360, 487 (2002) [PDF]

S. Scandolo and E. Tosatti
Molecular simulations break the ice
Physics World, August 2002, p. 25-26

G. Ballabio, G. Profeta, S. de Gironcoli, S. Scandolo, G.E. Santoro and E. Tosatti
Disproportionation phenomena on free and strained Sn/Ge(111) and Sn/Si(111) surfaces
Phys. Rev. Lett. 89, 126803 (2002)

P. Tangney and S. Scandolo
How well do Car-Parrinello Simulations reproduce the Born-Oppenheimer Surface? Theory and examples
J. Chem. Phys. 116, 14 (2002) [PDF]

G. Santoro, S. Scandolo, and E. Tosatti
Surface charge density waves and the Mott insulators for root 3 x root 3 adlayers on (111) semiconductor surfaces
Comp. Mater. Sci. 20, 343 (2001)

M.C. Righi, S. Scandolo, S. Serra, S. Iarlori, E. Tosatti, and G. Santoro
Surface States and Negative Electron Affinity in Polyethylene
Phys. Rev. Lett. 87, 076802 (2001)

D. Ceresoli, M.C. Righi, E. Tosatti, S. Scandolo, G. Santoro, and S. Serra
Electron-hole trapping and self--trapping in polyethylene
"Festschrift in Honor of F. Bassani", ed. by G. Grosso, G. Larocca and M.P . Tosi,
Scuola Normale Superiore, Pisa (2001)

S. Scandolo, F. Bassani, and V. Lucarini
Spatial-dispersion and relativistic effects in the optical sum rules
Eur. Phys. J. B 23, 319 (2001)

S. Scandolo, G.L. Chiarotti, E. Tosatti
Diamonds in the sky?
Physics World, October 2000, p. 31-36

S. Scandolo, F. Ancilotto, M. Bernasconi, C. Cavazzoni, G.L. Chiarotti, E. Tosatti, and M. Parrinello
Neptune's Deep Chemistry from Computer Simulations
Rev. High Pressure Sci. Technol. 11, 115 (2000)

R. Gebauer, S. Serra, G. Chiarotti, S. Scandolo, S. Baroni, and E. Tosatti
Non-colinear spin polarization from frustrated anti-ferromagnetism: a possible scenario for molecular oxygen at high pressure
Phys. Rev. B 61, 6145 (2000)

A. Laio, S. Bernard, G. L. Chiarotti, S. Scandolo, and E. Tosatti
Physics of iron at Earth's core conditions
SCIENCE 287, 1027 (2000)

J. Dong, J. K. Tomfohr, O. F. Sankey, C. Cavazzoni, G. L. Chiarotti, S. Scandolo, S. Serra, E. Tosatti and C. S. Yoo,
Non-Molecular Carbon Dioxide (CO2) Solids
SCIENCE 287 , 11 (2000) [Comment].

S. Scandolo and J. Kohanoff
Optimal basis set for electronic structure calculations in periodic systems
Phys. Rev. B 62, 15499 (2000)

G. Ballabio, S. Scandolo, and E. Tosatti
sqrt{3} x sqrt{3} R30^0 versus adatom-rest atom phases on (111) semiconductor surfaces
Phys. Rev. B 61, R13345 (2000)

S. de Gironcoli, S. Scandolo, G. Ballabio, G. Santoro, and E. Tosatti
The mechanism for the 3x3 distortion of Sn/Ge(111)
Surf. Sci. 454-456, 172 (2000)

G. Santoro, S. Scandolo, and E. Tosatti
Spectroscopic fingerprints of a surface Mott-Hubbard insulator: the case of SiC(0001)
Surf. Sci. 454-456, 534 (2000)

V.I. Anisimov, A.E. Bedin, M.A. Korotin, G. Santoro, S. Scandolo, E. Tosatti,
SiC(0001): A surface Mott-Hubbard insulator
Phys. Rev. B 61, 752 (2000)

S. Serra, E. Tosatti, S. Iarlori, S. Scandolo and G. Santoro
Interchain Electron States in Polyethylene
Phys. Rev. B 62, 4389 (2000)

S. Serra, S. Iarlori, E. Tosatti, S. Scandolo and G. Santoro
Dynamical and Thermal Properties of Polyethylene by Ab-Initio Simulation
Chem. Phys. Lett. 331, 339 (2000)

S. Serra, C. Cavazzoni, G. L. Chiarotti, S. Scandolo, and E. Tosatti
Pressure-induced solid carbonates from molecular CO2 by computer simulations
SCIENCE 284 , 788 (1999)

Zhao Ji-Jun, S. Scandolo, J. Kohanoff, G. L. Chiarotti, Erio Tosatti
Elasticity and Mechanical Instabilities of Diamond at Megabar Stresses: Implications for Diamond-Anvil-Cell Research
Appl. Phys. Lett. 75, 487 (1999)

J. Kohanoff, S, Scandolo, S. de Gironcoli, E. Tosatti
Dipole-quadrupole interactions and the nature of phase III of compressed hydrogen
Phys. Rev. Lett. 83, 4097 (1999)

C. Cavazzoni, G. L. Chiarotti, S. Scandolo, E. Tosatti, M. Bernasconi, and M. Parrinello
Superprotonic and metallic states of water and ammonia at giant planet conditions
SCIENCE 283 , 44 (1999)

G. Santoro, S. Scandolo, and E. Tosatti
Charge density waves and surface Mott insulators for adlayer structures on semiconductors: extended Hubbard modeling
Phys. Rev. B 59, 1891 (1999).

S. Bernard, Guido L. Chiarotti, S. Scandolo, E. Tosatti
Decomposition and Polymerization of Solid Carbon Monoxide under Pressure
Phys. Rev. Letters 81 , 2092 (1998)

S. Serra, Guido L. Chiarotti, S. Scandolo, E. Tosatti
Pressure-induced magnetic collapse and metallization of molecular oxygen: the zeta-O2 phase
Phys. Rev. Letters 80 , 5160 (1998).

Jorge Kohanoff and Sandro Scandolo
Solid Molecular Phases of Hydrogen via Constant-Pressure First-Principles Molecular Dynamics
Mat. Res. Soc. Proc. Symp., 499, 329 (1998)

Guido L. Chiarotti, F. Ancilotto, M. Bernasconi, S. Bernard, C. Cavazzoni, P. Focher, J. Kohanoff, M. Parrinello, S. Scandolo, S. Serra, and Erio Tosatti
Simple Molecular Systems at Very High Pressures: Computer Simulation Studies
Rev. High Pressure Sci. Technol. 7 , 172 (1998)

G. Santoro, S. Sorella, F. Becca, S. Scandolo, and E. Tosatti
Metallic charge density waves and surface Mott insulators for adlayer structures on semiconductors: extended Hubbard modeling
Surface Science, 402-404, 802 (1998).

S. Scandolo, F. Ancilotto, G.L. Chiarotti, G. Santoro, S. Serra and E. Tosatti
First Principles Calculations of Charge and Spin Density Waves of sqr{3}-Adsorbates on Semiconductors
Surface Science, 402-404, 808 (1998).

Z.Y. Lu, G.L. Chiarotti, S. Scandolo, and E. Tosatti
Atomic and electronic structure of ideal and reconstructed alpha-Sn (100) surfaces
Phys. Rev. B 58, 13698 (1998)

Z.Y. Lu, G.L. Chiarotti, S. Scandolo, and E. Tosatti
Theory of the 2x2 and 3x3 Reconstructions of the alpha-Sn (111) Surface
Il Nuovo Cimento D 20 , 1013 (1998).

S. Serra, E. Tosatti, S. Iarlori, S. Scandolo, G. Santoro, M. Albertini
Interchain States and the Negative Electron Affinity of Polyethylene
1998 Annual Report Conference on Electrical Insulation and Dielectric Phenomena, vol. 1. (New York, USA; IEEE, 1998). p. 19-22

Jorge Kohanoff, Sandro Scandolo, Guido L. Chiarotti, Erio Tosatti
Solid Molecular Hydrogen: the Broken-Symmetry Phase
Phys. Rev. Lett. 78, 2783 (1997)

F. Ancilotto, Guido L. Chiarotti, S. Scandolo, E. Tosatti
Dissociation of Methane into Hydrocarbons in Extreme (Planetary) Pressure and Temperature
SCIENCE 275 1288 (1997).

G.Chiarotti, S.Scandolo, C.Cavazzoni, S.Serra, E. Tosatti, F. Ancillotto, M. Bernasconi
High Pressure Physics via First Principles Computer Simulations
CINECA Report 1997, pp 608-618 (1997)

S. Scandolo, Guido L. Chiarotti, E. Tosatti
Stability of diamond at Megabar Pressures
Phys. Stat. Sol. (b) 198, 447 (1996)

S. Scandolo, Guido L. Chiarotti, and E. Tosatti
SC4: a metallic phase of carbon at terapascal pressures
Phys. Rev. B 53, 5051 (1996).

Z.Y. Lu, G.L. Chiarotti, S. Scandolo, and E. Tosatti
Atomic and electronic structure of the alpha-Sn (111) surface
Phys. Rev. B 54, 11769 (1996)

P.N. Rapapa and S. Scandolo
Universal Constraints for the Third-Harmonic Generation Susceptibility
J. Phys.: Cond. Matter 8, 6997 (1996)

S. Scandolo, M. Bernasconi, G.L. Chiarotti, P. Focher, and E. Tosatti
Pressure-induced transformation path of graphite to diamond
Phys. Rev. Letters 74, 4015 (1995).

M. Bernasconi, G.L. Chiarotti, P. Focher, S. Scandolo, E. Tosatti, and M. Parrinello
Pressure-induced solid-solid phase transformations via first-principle simulations
in ``Proceedings of the 22nd International Conference on The Physics of Semiconductors'', Vol. 1, ed. by D.J. Lockwood, World Scientific, Singapore (1995).

M. Bernasconi, G.L. Chiarotti, P. Focher, S. Scandolo, E. Tosatti, and M. Parrinello
First-principle constant pressure molecular dynamics
J. Phys. Chem. Solids 56, 501 (1995).

S. Scandolo and F. Bassani
Miller's rule and the static limit for second-harmonic generation
Phys. Rev. B 51, 6928 (1995)

S. Scandolo and F. Bassani
Kramers-Kronig relations and sum rules for the second-harmonic susceptibility
Phys. Rev. B 51, 6925 (1995)

C. Sirtori, F. Capasso, J. Faist, and S. Scandolo
Nonparabolicity and a sum rule associated with bound-to-bound and bound-to-continuum intersubband transitions
Phys. Rev. B 50, 8663 (1994)

S. Scandolo, A. Baldereschi
Tuning heterojunction band offsets by interface delta-doping
`Physical Concepts and Materials for Novel Optoelectronic Device Applications II', Proceeding Vol. no. 1985, Europto Series (1993)

S. Scandolo, A. Baldereschi, and F. Capasso
Very large chi2(2w) in the near-infrared in AlSb/GaSb-InAsSb/AlSb asymmetric quantum wells
`Physical Concepts and Materials for Novel Optoelectronic Device Applications II', Proceeding Vol. no. 1985, Europto Series (1993)

S. Scandolo, A. Baldereschi, and F. Capasso
Interband near-infrared second-harmonic generation with very large chi2(2w) in AlSb/GaSb-InAsSb/AlSb asymmetric quantum wells
Appl. Phys. Lett. 62, 3138 (1993)

S. Scandolo and F. Tassone
All-optical bistability in asymmetric quantum wells
`Proceedings of the NATO ARW on Frontiers of the Optical Phenomena in Semiconductor Structures of Reduced Dimensions', ed. D.J. Lockwood and A. Pinczuk, NATO ASI Series, vol. 248, Kluwer Academic Publishers, Dordrecht (1993)

S. Scandolo and F. Tassone
Optical bistability induced by charge separation in asymmetric quantum wells
Phys. Status Solidi (b) 173, 453 (1992)

F. Bassani and S. Scandolo
Sum rules for nonlinear optical susceptibilities
Phys. Status Solidi (b) 173, 263 (1992)

S. Scandolo and F. Bassani
A nonlinear sum rule for atomic hydrogen
Il Nuovo Cimento D 14, 873 (1992)

F. Bassani and S. Scandolo
Sum rules in nonlinear optics: prospects for nonlinear processes in quantum wells
`Optics on Excitons in Confined Systems', ed. A. D'Andrea, R. Del Sole, R. Girlanda, A. Quattropani (IOP Publishing, Bristol, 1992)

S. Scandolo and F. Bassani
Nonlinear sum rules: the three-level and the anharmonic-oscillator models
Phys. Rev. B 45, 13257 (1992) [PDF]

F. Bassani and S. Scandolo
Dispersion relations and sum rules in nonlinear optics
Phys. Rev. B 44, 8446 (1991) [PDF]