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Journal of Chemical Theory and Computation
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December 1, 2015
Sparkle/PM6 Parameters for all Lanthanide Trications from La(III) to Lu(III)
Ricardo O Freire, Alfredo M Simas
Inorganic Chemistry
|
April 26, 2005
Sparkle model for the calculation of lanthanide complexes: AM1 parameters for Eu(III), Gd(III), and Tb(III)
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Journal of Molecular Modeling
|
February 9, 2006
Lanthanide complex coordination polyhedron geometry prediction accuracies of ab initio effective core potential calculations
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Dalton Transactions (Cambridge, England : 2003)
|
February 18, 2011
Tuning of the excitation wavelength from UV to visible region in Eu(3+)-β-diketonate complexes: comparison of theoretical and experimental photophysical properties
V Divya, Ricardo O Freire, M L P Reddy
Journal of Computational Chemistry
|
August 19, 2005
Modeling lanthanide complexes: sparkle/AM1 parameters for ytterbium (III)
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Journal of Computational Chemistry
|
February 18, 2014
LUMPAC lanthanide luminescence software: Efficient and user friendly
José Diogo L Dutra, Thiago D Bispo, Ricardo O Freire
Journal of Chemical Information and Modeling
|
December 2, 2010
Would the pseudocoordination centre method be appropriate to describe the geometries of lanthanide complexes?
Danilo A Rodrigues, Nivan B da Costa, Ricardo O Freire
The Journal of Physical Chemistry. A
|
April 28, 2006
Sparkle/AM1 structure modeling of lanthanum (III) and lutetium (III) complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Journal of Chemical Theory and Computation
|
December 3, 2015
Sparkle/AM1 Parameters for the Modeling of Samarium(III) and Promethium(III) Complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Sparkle/PM3 Parameters for the Modeling of Neodymium(III), Promethium(III), and Samarium(III) Complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Page
of 5
Search research articles
Search
Showing results (1-10 of 46) with videos related to
Sort By:
Page
of 5
Journal of Chemical Theory and Computation
|
December 1, 2015
Sparkle/PM6 Parameters for all Lanthanide Trications from La(III) to Lu(III)
Ricardo O Freire, Alfredo M Simas
Inorganic Chemistry
|
April 26, 2005
Sparkle model for the calculation of lanthanide complexes: AM1 parameters for Eu(III), Gd(III), and Tb(III)
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Journal of Molecular Modeling
|
February 9, 2006
Lanthanide complex coordination polyhedron geometry prediction accuracies of ab initio effective core potential calculations
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Dalton Transactions (Cambridge, England : 2003)
|
February 18, 2011
Tuning of the excitation wavelength from UV to visible region in Eu(3+)-β-diketonate complexes: comparison of theoretical and experimental photophysical properties
V Divya, Ricardo O Freire, M L P Reddy
Journal of Computational Chemistry
|
August 19, 2005
Modeling lanthanide complexes: sparkle/AM1 parameters for ytterbium (III)
Ricardo O Freire, Gerd B Rocha, Alfredo M Simas
Journal of Computational Chemistry
|
February 18, 2014
LUMPAC lanthanide luminescence software: Efficient and user friendly
José Diogo L Dutra, Thiago D Bispo, Ricardo O Freire
Journal of Chemical Information and Modeling
|
December 2, 2010
Would the pseudocoordination centre method be appropriate to describe the geometries of lanthanide complexes?
Danilo A Rodrigues, Nivan B da Costa, Ricardo O Freire
The Journal of Physical Chemistry. A
|
April 28, 2006
Sparkle/AM1 structure modeling of lanthanum (III) and lutetium (III) complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Journal of Chemical Theory and Computation
|
December 3, 2015
Sparkle/AM1 Parameters for the Modeling of Samarium(III) and Promethium(III) Complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Sparkle/PM3 Parameters for the Modeling of Neodymium(III), Promethium(III), and Samarium(III) Complexes
Ricardo O Freire, Nivan B da Costa, Gerd B Rocha, et al.
Page
of 5