Páez-Hernández D - Search Results

1

Creation of an unexpected plane of enhanced covalency in cerium(III) and berkelium(III) terpyridyl complexes.

Gaiser AN, Celis-Barros C, White FD, Beltran-Leiva MJ, Sperling JM, Salpage SR, Poe TN, Gomez Martinez D, Jian T, Wolford NJ, Jones NJ, Ritz AJ, Lazenby RA, Gibson JK, Baumbach RE, Páez-Hernández D, Neidig ML, Albrecht-Schönzart TE. Gaiser AN, et al. Nat Commun. 2021 Dec 10;12(1):7230. doi: 10.1038/s41467-021-27576-y. Nat Commun. 2021. PMID: 34893651 Free PMC article.

2

Theoretical Method for an Accurate Elucidation of Energy Transfer Pathways in Europium(III) Complexes with Dipyridophenazine (dppz) Ligand: One More Step in the Study of the Molecular Antenna Effect.

Beltrán-Leiva MJ, Cantero-López P, Zúñiga C, Bulhões-Figueira A, Páez-Hernández D, Arratia-Pérez R. Beltrán-Leiva MJ, et al. Inorg Chem. 2017 Aug 7;56(15):9200-9208. doi: 10.1021/acs.inorgchem.7b01221. Epub 2017 Jul 10. Inorg Chem. 2017. PMID: 28692259

3

Electronic Structure and Properties of Berkelium Iodates.

Silver MA, Cary SK, Garza AJ, Baumbach RE, Arico AA, Galmin GA, Chen KW, Johnson JA, Wang JC, Clark RJ, Chemey A, Eaton TM, Marsh ML, Seidler K, Galley SS, van de Burgt L, Gray AL, Hobart DE, Hanson K, Van Cleve SM, Gendron F, Autschbach J, Scuseria GE, Maron L, Speldrich M, Kögerler P, Celis-Barros C, Páez-Hernández D, Arratia-Pérez R, Ruf M, Albrecht-Schmitt TE. Silver MA, et al. J Am Chem Soc. 2017 Sep 27;139(38):13361-13375. doi: 10.1021/jacs.7b05569. Epub 2017 Sep 14. J Am Chem Soc. 2017. PMID: 28817775

4

Ab initio calculations of heavy-actinide hexahalide compounds: do these heavy actinides behave like their isoelectronic lanthanide analogues?

Celis-Barros C , Páez-Hernández D , Beltrán-Leiva MJ , Arratia-Perez R . Celis-Barros C , et al. Phys Chem Chem Phys. 2018 Feb 7;20(6):4038-4049. doi: 10.1039/c7cp06585j. Phys Chem Chem Phys. 2018. PMID: 29354822

5

Theoretical Determination of Energy Transfer Processes and Influence of Symmetry in Lanthanide(III) Complexes: Methodological Considerations.

Beltrán-Leiva MJ, Páez-Hernández D, Arratia-Pérez R. Beltrán-Leiva MJ, et al. Inorg Chem. 2018 May 7;57(9):5120-5132. doi: 10.1021/acs.inorgchem.8b00159. Epub 2018 Apr 25. Inorg Chem. 2018. PMID: 29693385

6

Rare-Earth Metal(II) Aryloxides: Structure, Synthesis, and EPR Spectroscopy of [K(2.2.2-cryptand)][Sc(OC₆ H₂ tBu₂ -2,6-Me-4)₃ ].

Moehring SA, Beltrán-Leiva MJ, Páez-Hernández D, Arratia-Pérez R, Ziller JW, Evans WJ. Moehring SA, et al. Chemistry. 2018 Dec 5;24(68):18059-18067. doi: 10.1002/chem.201803807. Epub 2018 Nov 8. Chemistry. 2018. PMID: 30199585

7

Electronic, Magnetic, and Theoretical Characterization of (NH₄)₄UF₈, a Simple Molecular Uranium(IV) Fluoride.

Chemey AT, Celis-Barros C, Huang K, Sperling JM, Windorff CJ, Baumbach RE, Graf DE, Páez-Hernández D, Ruf M, Hobart DE, Albrecht-Schmitt TE. Chemey AT, et al. Inorg Chem. 2019 Jan 7;58(1):637-647. doi: 10.1021/acs.inorgchem.8b02800. Epub 2018 Dec 20. Inorg Chem. 2019. PMID: 30569705

8

Molecular and Electronic Structure, and Hydrolytic Reactivity of a Samarium(II) Crown Ether Complex.

White FD, Celis-Barros C, Rankin J, Solís-Céspedes E, Dan D, Gaiser AN, Zhou Y, Colangelo J, Páez-Hernández D, Arratia-Pérez R, Albrecht-Schmitt TE. White FD, et al. Inorg Chem. 2019 Mar 4;58(5):3457-3465. doi: 10.1021/acs.inorgchem.8b03566. Epub 2019 Feb 21. Inorg Chem. 2019. PMID: 30788962

9

Classical and Quantum Mechanical Calculations of the Stacking Interaction of Nd^III Complexes with Regular and Mismatched DNA Sequences.

Beltrán-Leiva MJ, Fuenzalida-Valdivia I, Cantero-López P, Bulhões-Figueira A, Alzate-Morales J, Páez-Hernández D, Arratia-Pérez R. Beltrán-Leiva MJ, et al. J Phys Chem B. 2019 Apr 18;123(15):3219-3231. doi: 10.1021/acs.jpcb.9b00703. Epub 2019 Apr 4. J Phys Chem B. 2019. PMID: 30925049

10

Structure, Spectroscopy, and Theoretical Analysis of Zero- and Three-Dimensional Lithium Plutonium Fluorides: Li₄PuF₈ and LiPuF₅.

Chemey AT, Celis-Barros C, Sperling JM, Páez-Hernández D, Albrecht-Schmitt TE. Chemey AT, et al. Inorg Chem. 2019 Nov 4;58(21):14790-14799. doi: 10.1021/acs.inorgchem.9b02466. Epub 2019 Oct 24. Inorg Chem. 2019. PMID: 31647651

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