E-LIB Suche - Ergebnisse für: Massaccesi, Gustavo E.

1

A variance-based optimization for determining ground and ex..:

Alcoba, Diego R. ; Oña, Ofelia B. ; Torre, Alicia...
The Journal of Chemical Physics. 160 (2024) 16 - p. , 2024

Link: https://doi.org/10.1063/..

2

DOCSIC: A Mean-Field Method for Orbital-by-Orbital Self-Int..:

Peralta, Juan E. ; Barone, Veronica ; Melo, Juan I....
The Journal of Physical Chemistry A. , 2024

Link: https://doi.org/10.1021/..

3

A quantum-chemical study of boro-fullerenes B60H60, B60F30H..:

Oña, Ofelia B. ; Ferrer, Maxime ; Alcoba, Diego R....
Computational and Theoretical Chemistry. 1220 (2023) - p. 113987 , 2023

Link: https://doi.org/10.1016/..

4

Studies of molecular dissociation by means of restricted an..:

Garcia, Javier ; Oña, Ofelia B. ; Torre, Alicia...
International Journal of Quantum Chemistry. 123 (2023) 14 - p. , 2023

Link: https://doi.org/10.1002/..

5

Generalized spin σ-SCF method:

Oña, Ofelia B. ; Massaccesi, Gustavo E. ; Melo, Juan I....
The Journal of Chemical Physics. 159 (2023) 21 - p. , 2023

Link: https://doi.org/10.1063/..

6

Variational determination of the two-electron reduced densi..:

Ríos, Elías ; Alcoba, Diego R. ; Lain, Luis...
The Journal of Chemical Physics. 157 (2022) 1 - p. , 2022

Link: https://doi.org/10.1063/..

7

Influence of the N-representability conditions on the varia..:

Corvalan, Dario A. ; Oña, Ofelia B. ; Alcoba, Diego R....
The Journal of Chemical Physics. 157 (2022) 20 - p. , 2022

Link: https://doi.org/10.1063/..

8

Exploiting the nearsightedness principle within the framewo..:

Honoré, Eduardo M. ; Ríos, Elías ; Alcoba, Diego R....
International Journal of Quantum Chemistry. 122 (2021) 6 - p. , 2021

Link: https://doi.org/10.1002/..

9

Variational determination of ground and excited-state two-e..:

Alcoba, Diego R. ; Oña, Ofelia B. ; Lain, Luis...
The Journal of Chemical Physics. 154 (2021) 22 - p. , 2021

Link: https://doi.org/10.1063/..

10

Symmetry-adapted formulation of the hybrid treatment result..:

Torres-Vega, Juan J. ; Massaccesi, Gustavo E. ; Ríos, Elías...
Journal of Mathematical Chemistry. 59 (2021) 2 - p. 488-504 , 2021

Link: https://doi.org/10.1007/..

11

Magnetic properties of closo-carborane-based Co(II) single-..:

Oña, Ofelia B. ; Alcoba, Diego R. ; Massaccesi, Gustavo E....
Polyhedron. 176 (2020) - p. 114257 , 2020

Link: https://doi.org/10.1016/..

12

Incorporating dynamic correlation into the variational dete..:

Alcoba, Diego R. ; Torre, Alicia ; Lain, Luis...
International Journal of Quantum Chemistry. 120 (2020) 15 - p. , 2020

Link: https://doi.org/10.1002/..

13

Variational determination of the two-electron reduced densi..:

Oña, Ofelia B. ; Torre, Alicia ; Lain, Luis...
The Journal of Chemical Physics. 153 (2020) 8 - p. , 2020

Link: https://doi.org/10.1063/..

14

Unrestricted treatment for the direct variational determina..:

Alcoba, Diego R. ; Torre, Alicia ; Lain, Luis...
The Journal of Chemical Physics. 150 (2019) 16 - p. , 2019

Link: https://doi.org/10.1063/..

15

Rebuilding racket on chez scheme (experience report):

Flatt, Matthew ; Derici, Caner ; Dybvig, R. Kent...
Proceedings of the ACM on Programming Languages. 3 (2019) ICFP - p. 1-15 , 2019

Link: https://dl.acm.org/doi/1..