Recherche
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(CaO)nIrO2 (n = 1, 2, 4) family: Chemical scissors effects of CaO on structural characteristics correlated to physical properties. Ab initio study
(Journal of Solid State Chemistry. vol. 255, pp. 82-88, 2017)Article de revue -
Strong p-magnetism in carbon suboxide C2O devised from first principles
(Chemical Physics Letters. vol. 674, pp. 115-119, 2017)Article de revue -
Unusual onset of p-element magnetization in a two dimensional structure
(Solid State Sciences. vol. 60, pp. 55-58, 2016)Article de revue -
First principles studies of hydrogen insertion effects on magnetic properties, bonding and structure reordering of UZr 2
(Computational Condensed Matter. vol. 12, pp. 19-24, 2017)Article de revue -
The gallium intermetallics REPdGa3 (RE = La, Ce, Pr, Nd, Sm, Eu) with SrPdGa3-type structure
(Zeitschrift fur Naturforschung B. vol. 69, n° 11-12, pp. 1105-1118, 2014)Article de revue -
Changes in electronic, magnetic and bonding properties from Zr2FeH5 to Zr3FeH7 addressed from ab initio
(Solid State Sciences. vol. 25, pp. 55-62, 2013)Article de revue -
Ab initio investigations of the electronic structures and chemical bonding in LiCo6P4 and Li2Co12P7
(Journal of Solid State Chemistry. vol. 202, pp. 227-233, 2013)Article de revue -
Light elements-induced iono-covalent character in MgH2: An ab-initio approach
(Computational Materials Science. vol. 69, pp. 424-427, 2013)Article de revue -
Electronic structure and bonding in YTi2Ga4 - A gallide with linear titanium chains and four-bonded gallium atoms
(Zeitschrift fur Naturforschung B. vol. 68, n° 1, pp. 23-28, 2013)Article de revue -
Hydrogen insertion effects on the electronic structure of equiatomic MgNi traced by ab initio calculations
(Zeitschrift fur Naturforschung B. vol. 68, n° 1, pp. 44-50, 2013)Article de revue