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Papers authored by Mario Piris

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2007 M. Piris

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, X. Lopez, J. M. Ugalde

Dispersion interactions within the Piris natural orbital functional theory: The helium dimer

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2006 Pavel Leiva, Mario Piris

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Calculation of vertical ionization potentials with the Piris natural orbital functional

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P. Leiva, M. Piris

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Description of high-spin restricted open-shell molecules with the Piris natural orbital functional

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Mario Piris

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A new approach for the two-electron cumulant in natural orbital functional theory

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2005 Pavel Leiva, Mario Piris

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A natural orbital functional study for the electric response properties of molecules

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Pavel Leiva, Mario Piris

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Natural orbital functional theory: ionization potentials, equilibrium geometries and vibrational frequencies

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Mario Piris

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, Peter Otto

Natural orbital functional for correlation in polymers

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P. Leiva, M. Piris

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Assessment of a new approach for the two-electron cumulant in natural-orbital-functional theory

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2004 P. Otto, M. Piris

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, A. Martinez, J. Ladik

Dynamic (hyper)polarizability calculations for polymers with linear and cyclic π-conjugated elementary cells

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Mario Piris

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, Alberto Martinez, Peter Otto

Natural orbital functional approach: Calculation of dielectric properties in molecules

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Mario Piris

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Natural orbital functional theory: Molecules and polymers

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2003 Mario Piris

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, Peter Otto

One-particle density matrix functional for correlation in molecular systems

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M. Piris

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Second Quantization for Fermions

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2001 M. Sosa Albertus, M. Piris

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Conformational analysis of 3,3-disubstituted benzoylthioureas using X-ray diffraction and ab initio calculations

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2000 Mario Piris

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, Peter Otto

The improved Bardeen–Cooper–Schrieffer method in polymers

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M. Sosa, M. Piris

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, G. Burton

3,3-Dimethylacylthioureas: "S", "-S", "U" or "W" Conformation?

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1999 Mario Piris

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A generalized self‐consistent‐field procedure in the improved BCS theory

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M. Sosa, M. Piris

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Estudio estructural de aciltioureas 3,3-dimetilsustituidas

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M. Piris

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Física Cuántica

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1998 Mario Piris

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Analytic gradients in the improved BCS method

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