Antoine D. Villesuzanne

First-principles study of the electronic and magnetic structures of the tetragonal and orthorhombic phases of Ca3Mn2O7

PHYSICAL REVIEW B, 76(5).

Comparative electronic band structure study of the intrachain ferromagnetic versus antiferromagnetic coupling in the magnetic oxides Ca3CO2O6 and Ca3FeRhO6

INORGANIC CHEMISTRY, 44(18), 6339–6345.

Large negative magnetoresistance of the rare-earth transition-metal intermetallic compound PrMnSi2

CHEMISTRY OF MATERIALS, 17(25), 6338–6341.

Observation of unusual hysteretic magnetic properties of the rare earth intermetallic compound PrMnSi2: Magnetic susceptibility, magnetization, heat capacity, and electronic band structure studies

CHEMISTRY OF MATERIALS, 17(14), 3711–3716.

Spin dimer and electronic band structure analyses of the ferromagnetism versus antiferromagnetism in SeCuO3 and TeCuO3

CHEMISTRY OF MATERIALS, 17(17), 4350–4355.

Synthesis and characterization of [PtIn6](GeO4)(2)O and its solid solution [PtIn6](GaO4)(2-x)(GeO4)(x)O-x/2 (0 <= x <= 2): Gradual color change of the solid solution from black (x=0) to yellow (x=2) as a consequence of quantum dot effect

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 127(37), 12990–12996.

Unpaired spin populations and spin-pairing tendencies of the nonequivalent vanadium sites of the magnetic metal NaV6O11 investigated by electronic band structure calculations and spin dimer analysis

CHEMISTRY OF MATERIALS, 17(17), 4344–4349.