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Mosaic misorientation linewidth model

Matrix diagonalization — mosaic misorientation linewidth model. [Pg.111]

An example demonstrating the efficiency of the SOPHE partition scheme in conjunction with the SOPHE interpolation scheme and the mosaic misorientation linewidth model is shown in Figure 43a-d, where we have calculated a randomly oriented spectrum for a high-spin rhombically distorted naturally abundant Cr(III) ion for which an appropriate spin Hamiltonian is... [Pg.154]

Figure 43. Computer simulations of the powder EPR spectrum from a naturally abundant Ciflll) spin system (S = 3/2 / = 3/2) that demonstrates the efficiency of the SOPHE interpolation scheme (a) without the SOPHE interpolation scheme, N= 18 (b) without the SOPHE interpolatirai scheme, N = 400 (c) with the SOPHE interpolation scheme, JV= 18 and (d) with the mosaic misorientation linewidth model, N = 18. Computational times were obtained on both a Linux PC (AMD Athlon XP2400+ CPU with the Mandrake 9.1 operating system) and an SGI supercomputer (MIPS R14K CPU with the IRIX 6.5.20 operating system) the latter times are given in brackets, v = 34 GHz field axis resolution 4096 points an isotropic Gaussian lineshape with a halfwidth at half-maximum of 30 MHz was used in the simulation. Figure 43. Computer simulations of the powder EPR spectrum from a naturally abundant Ciflll) spin system (S = 3/2 / = 3/2) that demonstrates the efficiency of the SOPHE interpolation scheme (a) without the SOPHE interpolation scheme, N= 18 (b) without the SOPHE interpolatirai scheme, N = 400 (c) with the SOPHE interpolation scheme, JV= 18 and (d) with the mosaic misorientation linewidth model, N = 18. Computational times were obtained on both a Linux PC (AMD Athlon XP2400+ CPU with the Mandrake 9.1 operating system) and an SGI supercomputer (MIPS R14K CPU with the IRIX 6.5.20 operating system) the latter times are given in brackets, v = 34 GHz field axis resolution 4096 points an isotropic Gaussian lineshape with a halfwidth at half-maximum of 30 MHz was used in the simulation.
See other pages where Mosaic misorientation linewidth model is mentioned: [Pg.119]    [Pg.150]    [Pg.151]    [Pg.153]    [Pg.153]    [Pg.153]    [Pg.154]    [Pg.154]    [Pg.682]    [Pg.119]    [Pg.150]    [Pg.151]    [Pg.153]    [Pg.153]    [Pg.153]    [Pg.154]    [Pg.154]    [Pg.682]   
See also in sourсe #XX -- [ Pg.153 , Pg.154 , Pg.155 ]



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