{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44714e-10 0.0 0.0 ] "source-value" [ 5.44714 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] "source-value" [ 0.103058 5.37075 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] "source-value" [ 0.0454409 0.00880856 5.43207 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.28958318931584e-12 8.273843866677367e-09 5.636966844139814e-10 ] [ 1.00129261592894e-08 -1.236891806820439e-08 -1.589443802759178e-08 ] [ -8.238641963488782e-09 1.14890480096594e-08 1.872083331825052e-08 ] [ 1.77412718249178e-09 -8.684384802902847e-09 1.009415651396396e-09 ] [ -2.320884053494044e-09 3.617161898614562e-09 9.706000067960662e-09 ] [ -4.369585856552044e-10 -3.413573155191844e-09 3.472031773554974e-09 ] [ -5.668242933954451e-10 4.571141918495953e-09 -6.027339581062666e-09 ] [ -2.3103386871936e-10 -3.484319506930537e-09 -1.155019972670443e-08 ] ] "source-value" [ [ 0.0045498000000000005 5.164127200000001 0.35183180000000003 ] [ 6.249577000000002 -7.720071500000002 -9.920528000000001 ] [ -5.142155900000001 7.170899800000002 11.684625200000001 ] [ 1.1073231000000001 -5.420366700000001 0.6300277000000001 ] [ -1.4485819000000002 2.2576549000000004 6.058008800000001 ] [ -0.27272810000000003 -2.1305848000000003 2.1670718000000004 ] [ -0.35378390000000004 2.8530824000000004 -3.761969500000001 ] [ -0.14420000000000002 -2.1747412000000006 -7.209067700000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.253492459044201e-18 "source-value" -26.548212 } }