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2001

BFS modeling of Cu-Pd alloys.
G. Bozzolo, J. Garces, H. Mosca, and J. Ferrante
(submitted)

Modeling of Substitutional Site Preference in Ordered Intermetallic Alloys: Heusler Alloys with Single Alloying Additions.
G. Bozzolo and R.D. Noebe
Intermetallics (submitted)

Modeling of the Site Preference in Ternary B2-Ordered Ni-Al-Fe Alloys.
G. Bozzolo, J. Khalil, and R.D. Noebe
Intermetallics 2001 (submitted) (Abstract)

Site Occupancy of Ternary Additions to B2 Alloys.
G. Bozzolo, R.D. Noebe, and C. Amador
Intermetallics (submitted) (Abstract)

Experimental Verification of the Theoretical Prediction of the Phase Structure of a Ni-Al-Ti-Cr-Cu Alloy.
A. Wilson, G. Bozzolo, R.D. Noebe and J.M. Howe
Acta Mat. (submitted) (Abstract)

Calculation of Alloy Equilibrium Properties from First-Principals and Quantum Approximate Methods.
G. Bozzolo and J.E. Garces
Phys. Rev. B (submitted) (Abstract)

Surface Composition of Alloys via BFS Atomistic Monte Carlo Simulation.
B. Good and G. Bozzolo
Surf.Sci. (submitted) (Abstract)

Atomistic Modeling of Cu on W low index surfaces.
J.E. Garces, G. Bozzolo, and G. Demarco
Surf.Sci. (submitted) (Abstract)

Modeling of 3C-SiC using the BFS Method for Alloys.
G. Bozzolo, J.E. Garces, and P. Abel
Surf.Sci. (submitted) (Abstract)

Surface Alloys of Pd and Cu via Atomistic Modeling.
J. Garces, G. Bozzolo, H. Mosca, and P. Abel
Surf.Sci. (2001) 482/485 (2001) 776 (Abstract)

Atomistic Modeling of Quaternary Alloys: Ti and Cu in NiAl.
G. Bozzolo, H. Mosca, A. Wilson, R.D. Noebe, and J.E. Garces
Met. Trans. A (2001) (submitted) (Abstract)

Microstructural Characterization of NiAl Alloys Containing ß' Precipitates and Comparison to Modeling Predictions Based on the BFS Method.
A.W. Wilson, G. Bozzolo, J.M. Howe, and R.D. Noebe
The Minerals, Metals and Materials Society (submitted) (Abstract)

Calculation of Thermal Expansion Coefficients of Pure Elements and their Alloys.
P. Abel and G. Bozzolo
Scripta Materialia (2001) (submitted) (Abstract)

Modeling of alloy surfaces, segregation and surface alloys.
G. Bozzolo in `Surface Alloys and Alloy Surfaces', The Chemical Physics of Solid Surfaces, Vol.10.,Elsevier, 2001

Atomistic Modeling of Ternary and Quaternary Ordered Intermetallic Alloys.
G. Bozzolo, J. Khalil, M. Bartow, and R.D. Noebe
Mat. Res. Soc. Symp. Proc. (2001) (accepted) (Abstract)

2000

Atomistic Modeling of the Site Occupancy of Ti and Cu in NiAl.
G. Bozzolo, R. D. Noebe and J. Garces.
Scripta Mater. 42 (2000) 403-408

Surface Segregation in Ternary Alloys.
B. Good, G. Bozzolo and P. Abel.
Surf.Sci. 456 (2000) 602-607(Abstract) & NASA TM 2000-209958

Surface Ternary Alloys of (Cu, Au)/Ni(110).
H. Mosca, J. Garces and G. Bozzolo.
Surf.Sci. 454-456 (2000) 707-711 (Abstract)

Atomistic Modeling of Pd/Cu(100) Surface Alloy Formation.
J. Garces, H. Mosca and G. Bozzolo.
Surf.Sci. 459 (2000) 365-389 (Abstract)

A New Approach for Atomistic Modeling of Pd/Cu(110) Surface Alloy Formation.
J. Garces, G. Bozzolo, P. Abel and H. Mosca.
Appl.Surf.Sci. 167 (2000) 18-33 (Abstract)

BFS Atomistic Simulations and Experimental Analysis of the Effect of Cr, Cu and Other Ternary Additions on the Structure of NiAl.
G. Bozzolo, R.D. Noebe, J. Ferrante, F.S. Honecy and C. Amador
Journal of Computer-Aided Materials Design (submitted), 2000 (Abstract)

Modeling of ternary element site substitution in NiAl.
G. Bozzolo, R.D. Noebe and F.S. Honecy.
Intermetallics 8(2000)7-18. (Abstract)

1999

The Role of Computational Modeling Processes in the Development and Understanding of NiAl-based Ordered Intermetallic Alloys.
G. Bozzolo, R.D. Noebe, F.S. Honecy and B. Good.
Mat.Res.Soc.Symp.Proc.,552(1999)693. (Abstract)

BFS Simulation and Experimental Analysis of the Effect of Ti Additions on the Structure of NiAl.
G. Bozzolo, R. Noebe, J. Ferrante, A. Garg, F.S. Honecy and C. Amador
J.Comp.Aid.Mat.Design,6,pp.33-68(1999) & NASA TM 1999-208892. (Abstract)

Surface Segregation in Ternary Alloys: a BFS Study of Ni-Al-Cu(100) Surface Composition.
F.S. Honecy, G. Bozzolo and B. Good
Appl.Surf.Sci.Vol.137,pp.157-162, 1999. (Abstract)

Surface Segregation in Multicomponent Systems: Modeling of Surface Alloys and Alloy Surfaces.
G. Bozzolo, J. Ferrante, R. D. Noebe, B. Good, F.S. Honecy and P. Abel
Comp.Mat.Sci.,15(1999),169-195. & NASA TM 1999-209042. (Abstract)

An Introduction to the BFS Method and its Use to Model Binary NiAl Alloys.
G. Bozzolo, R. D. Noebe, J. Ferrante, A. Garg and C. Amador
J.Comp.Aid.Mat.Design,6,pp.1-32(1999) & NASA TM 1998-208820 (Abstract)

Monte Carlo Prediction of Alloy Structure.
B. Good, G. Bozzolo, and Ronald D. Noebe
Mat. Res. Soc. Symp. Proc., Vol.551, Nov., 1999 (Abstract)

1998

Modeling of thin films via a semiempirical method.
Guillermo Bozzolo and John Ferrante
Thin Solid Films,317(1998)1-5. (Abstract)

A BFS Method Survey of Surface and Interfacial Properties of Multicomponent Systems.
G. Bozzolo, J. Ferrante and B. Good
Mat.Res.Soc.Symp.Proc. Vol.482(1998) (Abstract)

Modeling of Substitutional Site Preference in Ordered Intermetallic Alloys.
Guillermo Bozzolo, Ronald D. Noebe and Frank S. Honecy in 'Interstitial and Substitutional Solute Effects in Intermetallics', I. Baker, R.D. Noebe and E.P. George, eds. TMMMS, Warrendale, PA (1998) & NASA TM 1998-208665. (Abstract)

Computer Modeling Of Intermetallics.
G. Bozzolo and R.D. Noebe
Proceedings of CIMTEC98, Techna, Faenza, Italy, 1998. (Abstract)

1997

Atomistic Simulations of Alloying Additions to NiAl.
G. Bozzolo, R. D. Noebe, J. Ferrante and A. Garg.
Mat.Sci.&Eng.A, 239-240(1997)769-776. (Abstract)

Alloy Surface Structure: Computer Simulations using the BFS Method.
G. Bozzolo and J. Ferrante
Surf. Rev. Lett. 4 (1997) 825

Zero Temperature Analysis of the Defect Structure of B2 FeAl Alloys.
G. Bozzolo, J. Ferrante, R.D. Noebe and C. Amador
Scripta.Mater.Vol.36,No.7,pp.813-819, 1997. (Abstract)

Energetics of Ternary and Quaternary Alloy Surfaces.
Guillermo Bozzolo , John Ferrante and Ronald D. Noebe
Surf Sci.Vol.377-379,pp.1028-1032, 1997. (Abstract)

Atomistic Simulations of Ti Additions to NiAl.
Guillermo Bozzolo, Ronald D. Noebe, Anita Garg, John Ferrante and Carlos Amador
Mat.Res.Soc.Symp.Proc.,Vol.460,pp.443-448, 1997. (Abstract)

Progress in the Modeling of NiAl-Based Alloys Using the BFS Method.
Guillermo Bozzolo, Ronald D. Noebe, John Ferrante and Anita Garg.
Structural Intermetallics 1997. M.V. Nathal et.al.eds., TMMMS,1997,pp. 655 & NASA TM 113117, 1997. (Abstract)

Atomistic Simulations and Experimental Analysis of the Effect of Ti Additions on the Structure of NiAl.
Guillermo Bozzolo, Ronald D. Noebe, John Ferrante, Anita Garg and Carlos Amador.
NASA TM 113121, 1997. (Abstract)

Atomistic Simulations of Ti and Cr Alloying Additions to NiAl Using the BFS Method.
Guillermo Bozzolo, Ronald D. Noebe, John Ferrante, Anita Garg and Carlos Amador.
NASA TM 113119, 1997. (Abstract)

1996

Cu-Au Alloys using Monte Carlo Simulations and the BFS Method for Alloys
Guillermo Bozzolo, Brian Good & John Ferrante
Mat.Res.Soc.Symp.Proc.Vol.408, 1996. & NASA TM 107168, 1996. (Abstract)

Defect Structure of [B] NiAl using the BFS Method for Alloys.
G. Bozzolo, C. Amador, J. Ferrante and R.D. Noebe
Mat.Res.Soc.Symp.Proc.408, 1996. & NASA TM 107164, 1996. (Abstract)

Semiempirical Analysis of Surface Alloy Formation.
Guillermo Bozzolo, John Ferrante and Rodrigo Ibanez-Meier
Surf.Sci.Vol.352-354,pp.577-582, 1996. & NASA TM 107098, 1995. (Abstract)

1995

Surface Alloy Phases of Immiscible Metals: A Semiempirical Study of Au Growth on Ni(110).
Guillermo Bozzolo, Rodrigo Ibanez-Meier and John Ferrante
Mat.Res.Soc.Symp.Proc.Vol.355,pp.531, 1995. (Abstract)

Modeling of the Defect Structure of Beta-NiAl.
Guillermo Bozzolo, Carlos Amador, John Ferrante and Ronald D. Noebe
Scripta Met., Vol. 33, No 12, pp. 1907-1913. (Abstract)

Analysis of the Defect Structure of B2 FeAl Alloys.
Guillermo Bozzolo, John Ferrante, Ronald D. Noebe and Carlos Amador
NASA TM 107079, 1995. (Abstract)

Bulk Properties of Ni3Al(gamma') With Cu and Au Additions.
Guillermo Bozzolo and John Ferrante
J.Comp.-Aid.Mat.Des.Vol.2,pp.113-150, 1995. & NASA TM 106905, 1995. (Abstract)

Growth of Au on Ni(110): A semiempirical modeling of surface alloy phases.
Guillermo Bozzolo, Rodrigo Ibanez-Meier and John Ferrante
Phys.Rev.B,Vol.51,No.11,pp.7207, 1995. (Abstract)

1994

Composition dependence of bulk alloy properties.
Guillermo Bozzolo and John Ferrante
Phys.Rev.B,Vol.50,No.9,pp.5971, 1994. (Abstract)

Formation energy of disordered alloys from the energetics of ordered compounds.
Carlos Amador and Guillermo Bozzolo
Phys.Rev.B,Vol.49,No.2,pp.956, 1994. (Abstract)

Multilayer Relaxation and Surface Energies of Metallic Surfaces.
Guillermo Bozzolo, Agustin M. Rodriguez and John Ferrante
Surf.Sci.Vol.315,pp.204-214, 1994. (Abstract)

Structure and Energetics of High Index Fe, Al, Cu and Ni Surfaces Using Equivalent Crystal Theory.
Agustin M. Rodriguez, Guillermo Bozzolo and John Ferrante
Surf.Sci.Vol.307-309,pp.625-631, 1994. & NASA TM 106408, 1993. (Abstract)

Multilayer Relaxation and Surface Structure of Ordered Alloys.
Robert J. Kobistek, Guillermo Bozzolo, John Ferrante and Herbert Schlosser
Surf. Sci., Vol. 307-309, pp. 390-395, 1994 & NASA TM 106433, 1993. (Abstract)

Growth of Au on Ni(110): A BFS Modeling of Surface Alloy Phases.
Guillermo Bozzolo, Rodrigo Ibanez-Meier and John Ferrante
NASA TM 106732, 1994. (Abstract)

Modeling of Surfaces Part I-Monatomic Metallic Surfaces Using Equivalent Crystal Theory.
Guillermo Bozzolo, John Ferrante and Agustin M. Rodriguez
NASA TM 106680, Jul., 1994. (Abstract)

Modeling of Surfaces Part II-Metallic Alloy Surfaces Using the BFS Method.
Guillermo Bozzolo, John Ferrante and Robert J. Kobistek
NASA TM 106675, Jul., 1994. (Abstract)

1993

A New Semiempirical Method for Calculation of Segregation and Interfacial Energies in Metallic Systems.
G. Bozzolo and J. Ferrante
Materials Science Forum, Vol. 126, pp. 225, Trans Tech Publications Ltd., 1993. (Abstract)

Modeling of Surfaces. 1. Monatomic Metallic Surfaces Using Equivalent Crystal Theory.
Guillermo Bozzolo, John Ferrante and Agustin M. Rodriguez
J.Comp.-Aid.Mat.Des.Vol.1,pp.285-304, 1993. (Abstract)

Modeling of Surfaces. 2. Metallic Alloy Surfaces Using the BFS Method.
Guillermo Bozzolo, John Ferrante and Robert J. Kobistek
J.Comp.-Aid.Mat.Des.Vol.1,pp.305-324, 1993. (Abstract)

Surface segregation in Cu-Ni alloys.
Brian Good, Guillermo Bozzolo and John Ferrante
Phys.Rev.B,Vol.48,No.24,pp.18284,1993. (Abstract)

Heat of Segregation of Single Substitutional Impurities.
Guillermo Bozzolo, Brian Good and John Ferrante
Surf.Sci.Vol.289,pp.169-179, 1993 (Abstract)

Multilayer Relaxation of fcc and bcc Metals using Equivalent Crystal Theory.
Agustin M. Rodriguez, Guillermo Bozzolo & John Ferrante
Surf.Sci.,Vol.289,pp.100, 1993. (Abstract)

Extension of a New Semiempirical Method (BFS) and the Study of Ground State Properties of Binary Alloys.
G. Bozzolo and J. Ferrante
Mat.Res.Soc.Symp.Proc.Vol.291,pp.389, 1993. (Abstract)

1992

The Role of Adhesion in Wear.
J. Ferrante and G. Bozzolo
Characterization of Tribological Materials., W. Glaeser, ed. , Butterworth Publishers, 1992. (Introduction)

Computational Techniques in Tribology and Material Science at the Atomic Level.
J. Ferrante and G. Bozzolo
Fundamentals of Friction: Macroscopic and Microscopic Processes., I. L. Singer and H. M. Pollock, eds., Kluwer Academic Publishers, Netherlands, 1992. (Abstract)

New Semi-Empirical Method for Alloys.
Guillermo Bozzolo and John Ferrante
Mat.Res.Soc.Symp.Proc.Vol.278,pp.331-336, 1992. (Abstract)

Lattice Parameters of fcc Binary Alloys Using A New Semiempirical Method.
Guillermo Bozzolo and John Ferrante
Scripta Met.,Vol.26,No.8,pp.1275-1280, 1992. (Abstract)

A New Approximate Sum Rule for Bulk Alloy Properties.
Guillermo Bozzolo and John Ferrante
Scripta Met.Vol.26,No.6,pp.907-912,1992. & NASA TM 105282, 1991. (Abstract)

Determination of parameters of a method for predicting alloy properties.
Guillermo Bozzolo and John Ferrante
Phys.Rev.B,Vol.46,No.13,pp.8600, 1992. (Abstract)

Determination of Parameters of a New Method for Predicting Alloy Properties.
Guillermo Bozzolo and John Ferrante
NASA TM 105895, 1992. (Abstract)

Computational Techniques in Tribology and Material Science at the Atomic Level.
J. Ferrante and G.H. Bozzolo
NASA TM 105573, 1992. (Abstract)

Heats of formation of bcc binary alloys.
Guillermo Bozzolo and John Ferrante
Phys.Rev.B,Vol.45,No.21,pp.12191, 1992. (Abstract)

Method for Calculating Alloy Energetics.
(* THE ORIGINAL BFS PAPER!*)
G. Bozzolo, J. Ferrante and J. R. Smith
Phys.Rev.B,Vol.45,No.1,pp.493-6,1992. (Abstract)

1991

Equivalent Crystal Theory of Metals and Semiconductors Defects.
J. R. Smith, A. Banerjea, T. Perry, J. Ferrante and G. Bozzolo
Phys. Rev. B, 44, pp. 6444, 1991 (Abstract)

Universal Behavior in Ideal Slip.
G. Bozzolo, J. Ferrante and J.R. Smith
Scripta Metall. Mater. 25, pp.1927, 1991.

Heats of Formation of BCC Binary Alloys.
Guillermo Bozzolo, John Ferrante and John R. Smith
NASA TM 105281, 1991. (Abstract)

Theoretical Modelling of AFM for Bimetallic Tip-Substrate Interactions.
Guillermo Bozzolo and John Ferrante
NASA TM 105280, 1991. (Abstract)

Equivalent Crystal Theory of Alloys.
Guillermo Bozzolo and John Ferrante
NASA TP 3155, Sep, 1991. (Abstract)

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. . . Last updated July 20, 2001 -acz