Reta D - Search Results

1

Calix[n]arene-based polyradicals: enhancing ferromagnetism by avoiding edge effects.

Reta D, Moreira IPR, Illas F. Reta D, et al. Phys Chem Chem Phys. 2017 Sep 13;19(35):24264-24270. doi: 10.1039/c7cp04145d. Phys Chem Chem Phys. 2017. PMID: 28848984

2

Design of multi-functional 2D open-shell organic networks with mechanically controllable properties.

Alcón I, Reta D, Moreira IPR, Bromley ST. Alcón I, et al. Among authors: reta d. Chem Sci. 2017 Feb 1;8(2):1027-1039. doi: 10.1039/c6sc01412g. Epub 2016 Aug 31. Chem Sci. 2017. PMID: 28451241 Free PMC article.

3

Post-B3LYP Functionals Do Not Improve the Description of Magnetic Coupling in Cu(II) Dinuclear Complexes.

Costa R, Reta D, Moreira IPR, Illas F. Costa R, et al. Among authors: reta d. J Phys Chem A. 2018 Apr 5;122(13):3423-3432. doi: 10.1021/acs.jpca.7b12663. Epub 2018 Mar 22. J Phys Chem A. 2018. PMID: 29509020

4

Magnetic Coupling Constants in Three Electrons Three Centers Problems from Effective Hamiltonian Theory and Validation of Broken Symmetry-Based Approaches.

Reta D, Moreira Ide P, Illas F. Reta D, et al. J Chem Theory Comput. 2016 Jul 12;12(7):3228-35. doi: 10.1021/acs.jctc.6b00413. Epub 2016 Jun 10. J Chem Theory Comput. 2016. PMID: 27231983

5

Redox-Induced Gating of the Exchange Interactions in a Single Organic Diradical.

Gaudenzi R, de Bruijckere J, Reta D, Moreira IPR, Rovira C, Veciana J, van der Zant HSJ, Burzurí E. Gaudenzi R, et al. Among authors: reta d. ACS Nano. 2017 Jun 27;11(6):5879-5883. doi: 10.1021/acsnano.7b01578. Epub 2017 May 16. ACS Nano. 2017. PMID: 28494146 Free PMC article.

6

Uncertainty estimates for magnetic relaxation times and magnetic relaxation parameters.

Reta D , Chilton NF . Reta D , et al. Phys Chem Chem Phys. 2019 Nov 14;21(42):23567-23575. doi: 10.1039/c9cp04301b. Epub 2019 Oct 17. Phys Chem Chem Phys. 2019. PMID: 31620733

7

Bis-Monophospholyl Dysprosium Cation Showing Magnetic Hysteresis at 48 K.

Evans P, Reta D, Whitehead GFS, Chilton NF, Mills DP. Evans P, et al. Among authors: reta d. J Am Chem Soc. 2019 Dec 18;141(50):19935-19940. doi: 10.1021/jacs.9b11515. Epub 2019 Dec 5. J Am Chem Soc. 2019. PMID: 31751131 Free PMC article.

8

Synthesis and Electronic Structures of Heavy Lanthanide Metallocenium Cations.

Goodwin CAP, Reta D, Ortu F, Chilton NF, Mills DP. Goodwin CAP, et al. Among authors: reta d. J Am Chem Soc. 2017 Dec 27;139(51):18714-18724. doi: 10.1021/jacs.7b11535. Epub 2017 Dec 14. J Am Chem Soc. 2017. PMID: 29182861 Free article.

9

Unparalleled selectivity and electronic structure of heterometallic [LnLn'Ln] molecules as 3-qubit quantum gates.

Maniaki D, Garay-Ruiz D, Barrios LA, Martins DOTA, Aguilà D, Tuna F, Reta D, Roubeau O, Bo C, Aromí G. Maniaki D, et al. Among authors: reta d. Chem Sci. 2022 Apr 14;13(19):5574-5581. doi: 10.1039/d2sc00436d. eCollection 2022 May 18. Chem Sci. 2022. PMID: 35694338 Free PMC article.

10

Ab Initio Prediction of High-Temperature Magnetic Relaxation Rates in Single-Molecule Magnets.

Reta D, Kragskow JGC, Chilton NF. Reta D, et al. J Am Chem Soc. 2021 Apr 21;143(15):5943-5950. doi: 10.1021/jacs.1c01410. Epub 2021 Apr 6. J Am Chem Soc. 2021. PMID: 33822599

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