Influence of the S3 term on the EPR spectrum of Cr3+ in cubic symmetry sites in MgO

1981 ◽  
Vol 44 (3) ◽  
pp. 479-482 ◽  
Author(s):  
Ronaldo S de Biasi
Keyword(s):  
2004 ◽  
Vol 18 (02n03) ◽  
pp. 83-97 ◽  
Author(s):  
R. P. SREEKANTH CHAKRADHAR ◽  
K. P. RAMESH ◽  
J. L. RAO ◽  
J. RAMAKRISHNA

Mixed alkali borate x Na 2 O -(30-x) K 2 O -70 B 2 O 3(5≤x≤25) glasses doped with 0.5 mol% of gadolinium ions have been investigated by using electron paramagnetic resonance (EPR) and optical absorption techniques, as a function of alkali content, to look for the "mixed alkali effect" on the spectral properties of the glasses. The EPR spectrum consists of three prominent features with effective g-values, g≈5.6, 2.8 and 2.0, and two weak features at g≈3.3 and 4.3. The three EPR signals at g≈2.0, g≈2.8 and g≈5.6 are attributed to Gd 3+ ions located at sites with weak, intermediate and strong cubic symmetry fields, respectively. In principle these sites may be of network forming and network modifying types. Ionic radius considerations suggest that gadolinium ions cannot substitute the much smaller boron ions and thus only the network modifier site is acceptable. The number of spins (N) participating in resonance and its paramagnetic susceptibility (χ) for g≈5.6 resonance line have been calculated. It is interesting to note that N and χ increase with x and reach a maximum around x=15 and thereafter decrease showing the mixed alkali effect in these glasses. From ultraviolet absorption edges, the optical band gap energies were evaluated. It is interesting to note that the optical band gap energies for these glasses decrease slightly with increasing x and reach a minimum around x=10, and thereafter increase showing the mixed alkali effect. Optical band gap energies (E opt ) obtained in the present work vary from 2.20–3.35 eV for both the direct and indirect transitions. The physical parameters of the glasses have been evaluated with respect to the composition.


Author(s):  
Wenwu Cao

Domain structures play a key role in determining the physical properties of ferroelectric materials. The formation of these ferroelectric domains and domain walls are determined by the intrinsic nonlinearity and the nonlocal coupling of the polarization. Analogous to soliton excitations, domain walls can have high mobility when the domain wall energy is high. The domain wall can be describes by a continuum theory owning to the long range nature of the dipole-dipole interactions in ferroelectrics. The simplest form for the Landau energy is the so called ϕ model which can be used to describe a second order phase transition from a cubic prototype,where Pi (i =1, 2, 3) are the components of polarization vector, α's are the linear and nonlinear dielectric constants. In order to take into account the nonlocal coupling, a gradient energy should be included, for cubic symmetry the gradient energy is given by,


1978 ◽  
Vol 3 ◽  
pp. 479-501 ◽  
Author(s):  
E. Du Trémolet de Lacheisserie ◽  
P. Morin ◽  
J. Rouchy

2020 ◽  
Author(s):  
David Zanders ◽  
Goran Bačić ◽  
Dominique Leckie ◽  
Oluwadamilola Odegbesan ◽  
Jeremy M. Rawson ◽  
...  

Attempted preparation of a chelated Co(II) β-silylamide re-sulted in the unprecedented disproportionation to Co(0) and a spirocyclic cobalt(IV) bis(β-silyldiamide): [Co[(NtBu)2SiMe2]2] (1). Compound 1 exhibits a room temperature magnetic moment of 1.8 B.M and a solid state axial EPR spectrum diagnostic of a rare S = 1/2 configuration. Semicanonical coupled-cluster calculations (DLPNO-CCSD(T)) revealed the doublet state was clearly preferred (–27 kcal/mol) over higher spin configurations for which density functional theory (DFT) showed no energetic preference. Unlike other Co(IV) complexes, 1 had remarkable thermal stability, and was demonstrated to form a stable self-limiting monolayer in initial atomic layer deposition (ALD) surface saturation tests. The ease of synthesis and high-stability make 1 an attractive starting point to begin investigating otherwise inaccessible Co(IV) intermediates and synthesizing new materials.


2003 ◽  
Vol 792 ◽  
Author(s):  
V. Aubin ◽  
D. Caurant ◽  
D. Gourier ◽  
N. Baffier ◽  
S. Esnouf ◽  
...  

ABSTRACTProgress on separating the long-lived fission products from the high level radioactive liquid waste (HLW) has led to the development of specific host matrices, notably for the immobilization of cesium. Hollandite (nominally BaAl2Ti6O16), one of the main phases constituting Synroc, receives renewed interest as specific Cs-host wasteform. The radioactive cesium isotopes consist of short-lived Cs and Cs of high activities and Cs with long lifetime, all decaying according to Cs+→Ba2++e- (β) + γ. Therefore, Cs-host forms must be both heat and (β,γ)-radiation resistant. The purpose of this study is to estimate the stability of single phase hollandite under external β and γ radiation, simulating the decay of Cs. A hollandite ceramic of simple composition (Ba1.16Al2.32Ti5.68O16) was essentially irradiated by 1 and 2.5 MeV electrons with different fluences to simulate the β particles emitted by cesium. The generation of point defects was then followed by Electron Paramagnetic Resonance (EPR). All these electron irradiations generated defects of the same nature (oxygen centers and Ti3+ ions) but in different proportions varying with electron energy and fluence. The annealing of irradiated samples lead to the disappearance of the latter defects but gave rise to two other types of defects (aggregates of light elements and titanyl ions). It is necessary to heat at relatively high temperature (T=800°C) to recover an EPR spectrum similar to that of the pristine material. The stability of hollandite phase under radioactive cesium irradiation during the waste storage is discussed.


2021 ◽  
Vol 60 (16) ◽  
pp. 9009-9014
Author(s):  
George Serghiou ◽  
Hans Josef Reichmann ◽  
Nicholas Odling ◽  
Kristina Spektor ◽  
Anna Pakhomova ◽  
...  
Keyword(s):  
Group Iv ◽  

1980 ◽  
Vol 255 (23) ◽  
pp. 11204-11209 ◽  
Author(s):  
B.C. Antanaitis ◽  
P. Aisen ◽  
H.R. Lilienthal ◽  
R.M. Roberts ◽  
F.W. Bazer
Keyword(s):  

2021 ◽  
Vol 47 (1) ◽  
pp. 7-13
Author(s):  
S. V. Gudina ◽  
A. S. Bogolubskiy ◽  
V. N. Neverov ◽  
K. V. Turutkin ◽  
N. G. Shelushinina ◽  
...  

2021 ◽  
Vol 103 (12) ◽  
Author(s):  
Nazir Khan ◽  
Danil Prishchenko ◽  
Mary H. Upton ◽  
Vladimir G. Mazurenko ◽  
Alexander A. Tsirlin
Keyword(s):  

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