Daniel Claudino
Affiliations: | Virginia Polytechnic Institute and State University, Blacksburg, VA, United States |
Area:
Quantum Chemistry, Theoretical Chemistry, Quantum Computing, Electronic StructureGoogle:
"Daniel Claudino"Bio:
https://ufl-flvc.primo.exlibrisgroup.com/permalink/01FALSC_UFL/6ad6fc/alma990365662710306597
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Parents
Sign in to add mentor| José Manuel Riveros | research assistant | USP | ||
| Rodney J. Bartlett | grad student | 2018 | UF Gainesville | |
| (Atomic Natural Orbital Basis Sets Based on Coupled Cluster Theory) | ||||
| Nicholas J. Mayhall | post-doc | Virginia Tech | ||
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Publications
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| Bylaska EJ, Song D, Bauman NP, et al. (2021) Quantum Solvers for Plane-Wave Hamiltonians: Abridging Virtual Spaces Through the Optimization of Pairwise Correlations. Frontiers in Chemistry. 9: 603019 |
| Grimsley HR, Claudino D, Economou SE, et al. (2019) Is the Trotterized UCCSD Ansatz Chemically Well-Defined? Journal of Chemical Theory and Computation |
| Claudino D, Mayhall NJ. (2019) Simple and Efficient Truncation of Virtual Spaces in Embedded Wave Functions via Concentric Localization. Journal of Chemical Theory and Computation |
| Claudino D, Mayhall NJ. (2019) Automatic partition of orbital spaces based on singular value decomposition in the context of embedding theories. Journal of Chemical Theory and Computation |
| Claudino D, Bartlett RJ. (2018) Coupled-cluster based basis sets for valence correlation calculations. New primitives, frozen atomic natural orbitals, and basis sets from double to hextuple zeta for atoms H, He, and B-Ne. The Journal of Chemical Physics. 149: 064105 |
| Claudino D, Gargano R, Bartlett RJ. (2016) Erratum: "Coupled-cluster based basis sets for valence correlation calculations" [J. Chem. Phys. 144, 104106 (2016)]. The Journal of Chemical Physics. 145: 019901 |
| Claudino D, Gargano R, Silva VH, et al. (2016) Investigation of the Abstraction and Dissociation Mechanism in the Nitrogen Trifluoride Channels: Combined Post-Hartree-Fock and TST Approaches. The Journal of Physical Chemistry. A |
| Claudino D, Gargano R, Bartlett RJ. (2016) Coupled-cluster based basis sets for valence correlation calculations. The Journal of Chemical Physics. 144: 104106 |
| Margraf JT, Claudino D, Bartlett RJ. (2016) Determination of consistent semiempirical one-centre integrals based on coupled-cluster theory Molecular Physics. 115: 538-544 |