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Lanthanide Photocatalysis.
Qiao Y, Schelter EJ. Qiao Y, et al. Acc Chem Res. 2018 Nov 20;51(11):2926-2936. doi: 10.1021/acs.accounts.8b00336. Epub 2018 Oct 18. Acc Chem Res. 2018. PMID: 30335356
Among the lanthanides, we have focused on cerium because of the doublet to doublet 4f 5d excitation and emission, which affords good conservation of energy without losses through spin-state changes, as well as a large natural abundance of that element. ...
Among the lanthanides, we have focused on cerium because of the doublet to doublet 4f 5d excitation and emission, which affords good …
Are lanthanide-transition metal direct bonds a route to achieving new generation {3d-4f} SMMs?
Swain A, Sen A, Rajaraman G. Swain A, et al. Dalton Trans. 2021 Nov 16;50(44):16099-16109. doi: 10.1039/d1dt02256c. Dalton Trans. 2021. PMID: 34647556
Bonding analysis reveals a dative Ln-TM bond with a donation of pi(V/Mnd(xy)-pi*CO) to 5d(z(2)) (Gd) in the case of Gd-V and Gd-Mn and 4s(Co) to 5d(xy)/5d(yz) (Gd) for Gd-Co with the transition metal ion being found in the low-spin S = configurations in all t …
Bonding analysis reveals a dative Ln-TM bond with a donation of pi(V/Mnd(xy)-pi*CO) to 5d(z(2)) (Gd) in the case of Gd-V and Gd-Mn an …
Strong Ferromagnetic Exchange Coupling and Single-Molecule Magnetism in MoS43--Bridged Dilanthanide Complexes.
Darago LE, Boshart MD, Nguyen BD, Perlt E, Ziller JW, Lukens WW, Furche F, Evans WJ, Long JR. Darago LE, et al. J Am Chem Soc. 2021 Jun 9;143(22):8465-8475. doi: 10.1021/jacs.1c03098. Epub 2021 May 24. J Am Chem Soc. 2021. PMID: 34029482
UV-Vis-NIR diffuse reflectance spectra and DFT calculations of 1-Ln reveal a low-energy metal-to-metal charge transfer transition assigned to charge transfer from the singly occupied 4d(z(2)) orbital of Mo(V) to the empty 5d orbitals of the lanthanides (4d in the case of 1 …
UV-Vis-NIR diffuse reflectance spectra and DFT calculations of 1-Ln reveal a low-energy metal-to-metal charge transfer transition assigned t …
Sr[BeSi2 N4 ]:Eu2+ /Ce3+ and Eu[BeSi2 N4 ]: Nontypical Luminescence in Highly Condensed Nitridoberyllosilicates.
Strobel P, Weiler V, Schmidt PJ, Schnick W. Strobel P, et al. Chemistry. 2018 May 17;24(28):7243-7249. doi: 10.1002/chem.201800912. Epub 2018 Apr 30. Chemistry. 2018. PMID: 29575174
M[BeSi(2) N(4) ] (M=Sr,Eu), crystallizing in the hexagonal space group P6 2c, was synthesized from Sr(NH(2) )(2) , Be(3) N(2) , and "Si(NH)(2) " in W crucibles under a N(2) atmosphere in a radio-frequency furnace. ...Eu(2+) -doped beryllates with regular 4f(6) 5d(1) …
M[BeSi(2) N(4) ] (M=Sr,Eu), crystallizing in the hexagonal space group P6 2c, was synthesized from Sr(NH(2) )(2) , Be(3) N(2) , and " …
Coupled translation-rotation eigenstates of H(2) in C(60) and C(70) on the spectroscopically optimized interaction potential: Effects of cage anisotropy on the energy level structure and assignments.
Xu M, Sebastianelli F, Gibbons BR, Bacić Z, Lawler R, Turro NJ. Xu M, et al. J Chem Phys. 2009 Jun 14;130(22):224306. doi: 10.1063/1.3152574. J Chem Phys. 2009. PMID: 19530767 Free article.
We have developed a quantitatively accurate pairwise additive five-dimensional (5D) potential energy surface (PES) for H(2) in C(60) through fitting to the recently published infrared (IR) spectroscopic measurements of this system for H(2) in the vibrationally excited nu=1 …
We have developed a quantitatively accurate pairwise additive five-dimensional (5D) potential energy surface (PES) for H(2) in C(60) …