{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3028600999999997 -2.6022099999999995 5.187754599999999 ] [ 1.1783438999999998 -0.7125985999999999 -0.061496199999999994 ] [ -1.1504625999999998 -3.3491535999999997 -0.3845952999999999 ] [ 3.0156247999999994 0.5368309999999998 0.6781229999999999 ] [ -1.6568526999999997 2.4680662999999994 1.1495874999999998 ] [ -3.7936379999999996 3.6974350999999994 -4.602880299999999 ] [ -0.052738999999999994 0.09910179999999999 0.6578943999999999 ] [ -0.8431365999999999 -0.13747199999999998 -2.6243878999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.291765277590903e-09 -4.169200058761139e-09 8.311699203046014e-09 ] [ 1.887915063396432e-09 -1.141708826341112e-09 -9.852777471979078e-11 ] [ -1.843244296010888e-09 -5.365935641596981e-09 -6.1618960320622e-10 ] [ 4.831563591470921e-09 8.600980846068537e-10 1.086472825577982e-09 ] [ -2.654570681919811e-09 3.954278157022832e-09 1.841842231238474e-09 ] [ -6.078078161454491e-09 5.923944122951452e-09 -7.374627265758908e-09 ] [ -8.449719350052599e-11 1.587785883473412e-10 1.054063035319449e-09 ] [ -1.350853759790204e-09 -2.20254426229248e-10 -4.204732971932327e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.83272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.978640374266448e-18 } }