Miquel Llunell researcher
Llunell Marí, Miquel
VIAF ID: 309569919 ( Personal )
Permalink: http://viaf.org/viaf/309569919
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100 0 _ ‡a Miquel Llunell ‡c researcher
4xx's: Alternate Name Forms (3)
Works
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Calculation of exchange coupling constants in solid state transition metal compounds using localized atomic orbital basis sets |
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Color and Conductivity in Cu2O and CuAlO2: A Theoretical Analysis of d10···d10Interactions in Solid-State Compounds |
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Conformational analysis of molecular machines: internal rotation and enantiomerization in triptycyl[3]helicene |
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Desenvolupament d'un codi informàtic per a l'estudi de l'estructura electrònica de sistemes periòdics emprant mètodes semiempírics |
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Electronic structure and bonding in skutterudite-type phosphides |
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Electronic structure and magnetic properties of potassium ozonide KO(3) |
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Electronic structure and spin exchange interactions in Na(2)V(3)O(7): a vanadium(IV) oxide nanotubular phase |
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Electronic structure of Li2Ga and Li9Al4, two solids containing infinite and uniform zigzag chains |
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Electronic structure of the K3Bi2 metallic phase. |
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Estudi teòric de l'estereodinàmica de rotors i engranatges moleculars |
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Factors affecting the magnetic coupling in Sr2V3O9 type oxides: As for V substitution in the VO4 tetrahedra and nature of the cation |
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Host-guest interactions, uniform vs fragmented linear atom chains and likeliness of Peierls distortions in the (Ca7N4)[M(x)] (M = Ag, Ga, In) phases |
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Magnetic properties of cyano-bridged Ln3+-M3+ complexes. Part I: trinuclear complexes (Ln3+ = La, Ce, Pr, Nd, Sm; M3+ = FeLS, Co) with bpy as blocking ligand. |
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Minimal Distortion Pathways in Polyhedral Rearrangements |
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Molecules and crystals with both icosahedral and cubic symmetry |
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Reply to Comment on “Distortions in Octahedrally Coordinated d0Transition Metal Oxides: A Continuous Symmetry Measures Approach” |
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The rich stereochemistry of eight-vertex polyhedra: a continuous shape measures study. |
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Roles of cations, electronegativity difference, and anionic interlayer interactions in the metallic versus nonmetallic character of Zintl phases related to arsenic |
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Structural stability of quaternary ACuFeS2 (A = Li, K) phases: a computational approach |
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Theoretical determination of multiple exchange couplings and magnetic susceptibility data in inorganic solids: the prototypical case of Cu2(OH)3NO3. |
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