R. PICO; A. F. REBOLA; J. LASAVE; P. ABUFAGER; I. HAMAD

Modeling the Magnetic Properties of 1D Arrays of FePc Molecules

Journal of Physical Chemistry C; Año: 2024 vol. 128 p. 7266 - 7274

R. E. MENCHON; F. TORRESI; J LASAVE; S KOVAL

Shell-model and first-principles calculations of vibrational, structural and ferroelectric properties of KH2PO4

Condensed Matter Physics; Año: 2022 vol. 25

F. TORRESI; J LASAVE; S KOVAL

Path integral Monte Carlo simulations of the geometrical effects in KDP crystals

Condensed Matter Physics; Año: 2022 vol. 25

LASAVE, J.; KOVAL, S.; LAIO, A.; TOSATTI, E.

Proton strings and rings in atypical nucleation of ferroelectricity in ice

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA; Año: 2021 vol. 118

A. KHOSRAVI; J. LASAVE; S. KOVAL; E. TOSATTI

Ring population statistics in an ice lattice model

JOURNAL OF CHEMICAL PHYSICS; Lugar: New York; Año: 2021 vol. 155 p. 224502 - 224502

MENCHÓN, R.; COLIZZI, G.; JOHNSTON, C.; TORRESI, F.; LASAVE, J.; KOVAL, S.; KOHANOFF, J.; MIGONI, R.

Ab initio study of the structure, isotope effects, and vibrational properties in KDP crystals

Physical Review B; Año: 2018 vol. 98

LASAVE, J.; ABUFAGER, P.; KOVAL, S.

Ab initio study of the one-dimensional H-bonded ferroelectric CsH 2 PO 4

Physical Review B; Lugar: Washington, EE UU; Año: 2016 vol. 93

J. LASAVE; P ABUFAGER; S. KOVAL

Ab initio study of the one-dimensional H-bonded ferroelectric CsH 2PO4

PHYSICAL REVIEW B; Lugar: New York; Año: 2015

R. A. CASALI; J. LASAVE; M A CARAVACA; S KOVAL; C A PONCE; R L MIGONI

Ab initio and shell model studies of structural, thermoelastic and vibrational properties of SnO 2 under pressure

JOURNAL OF PHYSICS CONDENSED MATTER; Lugar: Londres; Año: 2013 vol. 25 p. 135404 - 135415

THOMAS J. EISENMAYER; JORGE LASAVE; ADRIANO MONTI; HUUB J.M. DE GROOT; FRANCESCO BUDA

Proton Displacements Coupled to Primary Electron Transfer in the Rhodobacter Sphaeroides Reaction Center

JOURNAL OF PHYSICAL CHEMISTRY B; Lugar: Washington, DC 20036; Año: 2013 vol. 38 p. 11162 - 11168

J. LASAVE; S. KOVAL; R. MIGONI; N. S. DALAL

Ab initio studies of the para- and antiferroelectric structures and local polarized configurations in NH4H2PO4

JOURNAL OF CHEMICAL PHYSICS; Lugar: New York; Año: 2011 vol. 135 p. 1 - 8

SERGIO KOVAL; JORGE LASAVE; JORGE KOHANOFF; RICARDO MIGONI

Shell Model Study of Local and Global Energy Barriers in KDP

FERROELECTRICS; Lugar: Londres; Año: 2010 vol. 401 p. 103 - 109

G. COLIZZI; J. KOHANOFF; J. LASAVE; R L MIGONI

Phonons, Instabilities and Origin of Polarization in KDP Crystals

FERROELECTRICS; Lugar: Londres; Año: 2010 vol. 401 p. 200 - 206

LASAVE, J.; J. KOVAL, S.; MIGONI, R.L.

Coexistence of ferroelectric and antiferroelectric microregions in the paraelectric phase of NH4H2PO4 (ADP)

PHYSICA B - CONDENSED MATTER; Lugar: Kidlington OX5 1GB, United Kingdom; Año: 2009 vol. 404 p. 2749 - 2750

LASAVE, J.; KOHANOFF, J.; MIGONI, R.L.; KOVAL, S.

A shell model for the H-bonded ferroelectric KH2PO4

PHYSICA B - CONDENSED MATTER; Lugar: DFDFDF; Año: 2009 vol. 404 p. 2736 - 2738

J. LASAVE; S. KOVAL; N. S. DALAL; R. L. MIGONI

Origin of Antiferroelectricity in NH4H2PO4 from First Principles - PRL 98, 267601 (2007)

PHYSICAL REVIEW LETTERS; Año: 2007 vol. 98 p. 1 - 4

J. LASAVE; S. F. KOVAL; N. S. DALAL; R. L. MIGONI

Ab initio study of the microscopic mechanism leading to antiferroelectricity in NH4H2PO4 (ADP)

FERROELECTRICS; Año: 2007

S. KOVAL; J. KOHANOF; J. LASAVE; G. COLIZZI; R. L. MIGONI

First-principles study of ferroelectricity and isotope effects in H-bonded KH2PO4 crystals - PHYSICAL REVIEW B 71, 184102 (2005)

PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS; Año: 2005 vol. 71 p. 1 - 15

J. LASAVE; S. KOVAL; N. S. DALAL; R. MIGONI

Slater and Takagi defects in KH2PO4 from first principles . PHYSICAL REVIEW B , 72, 104104 (2005)

PHYSICAL REVIEW B - CONDENSED MATTER AND MATERIALS PHYSICS; Año: 2005 vol. 72 p. 1 - 8

J LASAVE; F DOMINGUEZ; S. KOVAL; M G STACHIOTTI; R L MIGONI

Shell-model description of lattice dynamical properties of MgH2

JOURNAL OF PHYSICS CONDENSED MATTER; Año: 2005 vol. 17 p. 7133 - 7141

G. COLIZZI; J. KOHANOFF; J. LASAVE; S. KOVAL; R. L. MIGONI

Ab-Initio Investigations of Pressure Effects on the FerroelectricInstabilities in KDP and DKDP

FERROELECTRICS; Año: 2004 vol. 301 p. 61 - 64