JUAN CARLOS
SANCHO GARCIA
PROFESOR/A TITULAR UNIVERSIDAD
JOSE MARIA
PEREZ JORDA
PROFESOR/A TITULAR UNIVERSIDAD
Publicaciones en las que colabora con JOSE MARIA PEREZ JORDA (9)
2007
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Combining two-body density correlation functionals with multiconfigurational wave functions using natural orbitals and occupation numbers
Journal of Chemical Physics, Vol. 127, Núm. 10
2005
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Torsional potential of 4, 4′ -bipyridine: Ab initio analysis of dispersion and vibrational effects
Journal of Chemical Physics, Vol. 123, Núm. 13
2004
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Correlation factor approach to the correlation energy functional
Theoretical Chemistry Accounts, Vol. 111, Núm. 1, pp. 1-17
2002
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New correlation energy functionals with explicit dependence on the number of electrons
Journal of Chemical Physics, Vol. 116, Núm. 24, pp. 10571-10576
2001
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Characterizing conformers and torsional potentials of nitrosoformaldehyde and N-nitrosomethanimine
Journal of Chemical Physics, Vol. 115, Núm. 8, pp. 3698-3705
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High-level ab initio calculations of the torsional potential of glyoxal
Chemical Physics Letters, Vol. 342, Núm. 3-4, pp. 452-460
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New approach to the design of density functionals
Journal of Chemical Physics, Vol. 114, Núm. 5, pp. 2022-2026
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Torsional potential of 1,3-butadiene: Ab initio calculations
Molecular Physics, Vol. 99, Núm. 1, pp. 47-51
2000
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A DFT study of analytical correlated densities
Chemical Physics Letters, Vol. 331, Núm. 1, pp. 101-107