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1.
Effects of distortions in ion-host systems on optical spectra, crystal-field and spin-Hamiltonian parameters of Cr3+ ions doped pyrochlores Y2Ti2O7 and Y2Sn2O7: exchange charge model and superposition model calculations.
Phys Chem Chem Phys
; 25(6): 5082-5094, 2023 Feb 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-36723002
2.
DFT computations combined with semiempirical modeling of variations with temperature of spectroscopic and magnetic properties of Gd3+-doped PbTiO3.
Phys Chem Chem Phys
; 25(5): 3986-4004, 2023 Feb 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-36648488
3.
Eu3+ ions as a crystal-field probe for low-symmetry sites in doped phosphors - a case study: Eu3+ at triclinic sites in Li6RE(BO3)3 (RE = Y, Gd), YBO3 and ZnO and at trigonal sites in YAl3(BO3)4.
Phys Chem Chem Phys
; 25(37): 25537-25551, 2023 Sep 27.
Artículo
en Inglés
| MEDLINE | ID: mdl-37712933
4.
Importance of the fourth-rank zero field splitting parameters for Fe2+ (S = 2) adatoms on the CuN/Cu(100) surface evidenced by their determination based on DFT and experimental data.
Phys Chem Chem Phys
; 22(35): 19837-19844, 2020 Sep 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-32845270
5.
The High-Resolution 4f-5d Absorption Spectrum of Divalent Dysprosium (Dy2+) in Strontium Chloride Host SrCl2: Fine Structure and Zero-Phonon Transitions Revealed.
J Phys Chem A
; 122(4): 923-928, 2018 Feb 01.
Artículo
en Inglés
| MEDLINE | ID: mdl-29304287
6.
Extension of High-Resolution Optical Absorption Spectroscopy to Divalent Neodymium: Absorption Spectra of Nd2+ Ions in a SrCl2 Host.
Angew Chem Int Ed Engl
; 56(36): 10721-10724, 2017 08 28.
Artículo
en Inglés
| MEDLINE | ID: mdl-28683190
7.
Software package SIMPRE--revisited.
J Comput Chem
; 35(26): 1935-41, 2014 Oct 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-25082729
8.
Determination of crystal-field energy levels and temperature dependence of magnetic susceptibility for Dy3+ in [Dy2Pd] heterometallic complex.
Inorg Chem
; 52(22): 13199-206, 2013 Nov 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-24187974
9.
Understanding the effect of structural changes on slow magnetic relaxation in mononuclear octahedral copper(II) complexes.
Dalton Trans
; 51(32): 12041-12055, 2022 Aug 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-35876304
10.
Comment on the crystal-field analysis underlying "Breakdown of crystallographic site symmetry in lanthanide-doped NaYF4 crystals".
Angew Chem Int Ed Engl
; 54(4): 1074-6, 2015 Jan 19.
Artículo
en Inglés
| MEDLINE | ID: mdl-25425270
11.
Crystal-field energy level analysis for Nd(3+) ions at the low symmetry C(1) site in [Nd(hfa)(4)(H(2)O)](N(C(2)H(5))(4)) single crystals.
J Phys Condens Matter
; 20(38): 385205, 2008 Sep 24.
Artículo
en Inglés
| MEDLINE | ID: mdl-21693824
12.
Clarification of terminological confusion concerning the crystal field quantities vs. the effective spin Hamiltonian and zero-field splitting quantities in the papers by Bayrakçeken et al. [Spectrochim. Acta Part A 66 (2007) 462 and 1291].
Spectrochim Acta A Mol Biomol Spectrosc
; 71(4): 1623-6, 2008 Dec 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-18547860
13.
Electron magnetic resonance data on high-spin Mn(III; S=2) ions in porphyrinic and salen complexes modeled by microscopic spin Hamiltonian approach.
J Inorg Biochem
; 175: 36-46, 2017 10.
Artículo
en Inglés
| MEDLINE | ID: mdl-28692887
14.
EMR studies of the internal motion of Mn(4+) ions in the Sr overdoped (La(1-x)Sr(x))(Ga(1-y)Mn(y))O3 (x/y up to 8) supplemented by magnetic and optical spectroscopy measurements.
J Magn Reson
; 255: 77-87, 2015 Jun.
Artículo
en Inglés
| MEDLINE | ID: mdl-25917133
15.
Comparative analysis of crystal-field parameters for rare-earth ions at monoclinic sites in AB(WO4)2 crystals: II. Pr3+ and Nd3+ ions in KRE(WO4)2 (RE = Y or Gd), Pr3+ ions in M+ Bi(XO4)2 (M+ = Li or Na and X = W or Mo), and Nd3+ ions in NaBi(WO4)2 and AgNd(WO4)2.
J Phys Condens Matter
; 26(6): 065501, 2014 Feb 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-24441523
16.
Trends in orthorhombic crystal field parameters for trivalent rare-earth ions in high-Tc superconductors REBa2Cu3O7-δ - correct interpretation based on standardization.
Spectrochim Acta A Mol Biomol Spectrosc
; 103: 282-6, 2013 Feb 15.
Artículo
en Inglés
| MEDLINE | ID: mdl-23261624
17.
Comparative analysis of crystal-field parameters for rare-earth ions at monoclinic sites in AB(WO4)2 crystals: I. Tm3+ in KGd(WO4)2 and KLu(WO4)2, and Ho3+ and Er3+ ions in KGd(WO4)2.
J Phys Condens Matter
; 22(4): 045501, 2010 Feb 03.
Artículo
en Inglés
| MEDLINE | ID: mdl-21386316
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