FE VI, 3D3 Tue Aug 22 11:53:05 1995 J= .5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 26495.500 26494.221 1.279 99% 2P3 + 1% 4P3 + 18738.300 18739.575 -1.275 99% 4P3 + 1% 2P3 + J= 1.5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 72048.900 72049.418 -.518 78% 2D1 + 22% 2D3 + 0% 4P3 + 0% 4F3 28627.900 28626.516 1.384 46% 2D3 + 40% 2P3 + 13% 2D1 + 0% 4P3 26214.900 26216.700 -1.800 58% 2P3 + 31% 2D3 + 9% 2D1 + 2% 4P3 18942.000 18942.136 -.136 98% 4P3 + 2% 2P3 + 0% 2D3 + 0% 2D1 .000 -1.316 1.316 100% 4F3 + 0% 2D3 + 0% 2D1 + 0% 2P3 J= 2.5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 71707.600 71707.080 .520 80% 2D1 + 20% 2D3 + 0% 2F3 + 0% 4P3 46603.700 46604.857 -1.157 100% 2F3 + 0% 2D3 + 0% 2D1 + 0% 4F3 28484.300 28485.112 -.812 80% 2D3 + 20% 2D1 + 0% 4P3 + 0% 4F3 19610.800 19609.831 .969 100% 4P3 + 0% 2D1 + 0% 2D3 + 0% 4F3 511.300 510.749 .551 100% 4F3 + 0% 2D3 + 0% 2D1 + 0% 2F3 J= 3.5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 46217.300 46216.684 .616 100% 2F3 + 0% 2G3 + 0% 4F3 + 20616.400 20617.338 -.938 100% 2G3 + 0% 4F3 + 0% 2F3 + 1188.300 1188.095 .205 100% 4F3 + 0% 2G3 + 0% 2F3 + J= 4.5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 28724.300 28725.142 -.842 98% 2H3 + 2% 2G3 + 0% 4F3 + 21315.000 21313.444 1.556 98% 2G3 + 2% 2H3 + 0% 4F3 + 2000.600 2001.888 -1.288 100% 4F3 + 0% 2G3 + 0% 2H3 + J= 5.5 E(obs.) E(calc.) Delta Composition .................................................................................................................................. 29202.900 29202.461 .439 100% 2H3 + Characteristics of iteration no 6 Residual= .185E+02 Change in residual= .157E-05 Sigma= .130E+01 Parameter changes Initial data New Used Changed Variable Par.num. Parameter Parameter Difference Par.name Error Par.num. Relation Parameters 1 25752.6533 25752.6533 .0000 Eavd3 .298 1 1.00000 1 2 10619.9195 10619.9195 .0000 O2d3 .277 2 1.00000 1 3 7374.6465 7374.6465 .0000 O2'd3 .335 3 1.00000 1 4 501.0069 501.0069 .0000 Ea'd3 .203 4 1.00000 1 5 -228.0391 -228.0391 .0000 Eb'd3 .349 5 1.00000 1 6 594.4341 594.4341 .0000 Zetad .350 6 1.00000 1 7 -8.3472 -8.3472 .0000 T1 .012 7 1.00000 1 8 .6364 .6364 .0000 T2 .013 8 1.00000 1 9 -.0190 -.0190 .0000 T3 .000 9 1.00000 0 10 .0000 .0000 .0000 T4 .000 10 1.00000 0 11 3.0000 3.0000 .0000 Ac .000 11 1.00000 0 12 2.3000 2.3000 .0000 A3 .000 12 1.00000 0 13 3.8000 3.8000 .0000 A4 .000 13 1.00000 0 14 6.8000 6.8000 .0000 A5 .000 14 1.00000 0 15 -9.9000 -9.9000 .0000 A6 .000 15 1.00000 0 16 .5000 .5000 .0000 A1 .000 16 1.00000 0 17 -2.6000 -2.6000 .0000 A2 .000 17 1.00000 0 18 .5000 .5000 .0000 A0 .000 18 1.00000 0 19 .0000 .0000 .0000 Y1 .000 19 1.00000 0 20 .0000 .0000 .0000 Y3 .000 20 1.00000 0 21 .0000 .0000 .0000 Y6 .000 21 1.00000 0 22 .0000 .0000 .0000 Y7 .000 22 1.00000 0 Converged