{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.52208e-10 0.0 0.0 ] "source-value" [ 5.52208 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] "source-value" [ -0.0968577 5.45697 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] "source-value" [ 0.137264 0.147448 5.57607 ] } "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" [ [ -1.753423695980141e-10 3.644299726435334e-10 -8.675486794603912e-10 ] [ 5.732810651772691e-10 -1.086219031850024e-09 -4.417277848023399e-10 ] [ -1.18258354688466e-09 1.206144355181835e-09 5.597564514504479e-10 ] [ -2.064512562605042e-09 2.271916408997209e-09 -1.479873827580584e-09 ] [ -3.894694297440442e-10 -4.464751943474323e-10 -2.817582998809018e-10 ] [ 2.239365146810078e-09 -1.431935100909627e-09 -4.243489749965222e-10 ] [ 3.621242802685401e-10 -7.801432156539437e-10 1.59968475550167e-09 ] [ 6.37137416575874e-10 -9.771819406155072e-11 1.335816359768621e-09 ] ] "source-value" [ [ -0.1094401 0.2274593 -0.5414813 ] [ 0.3578139 -0.6779646 -0.2757048 ] [ -0.7381106 0.7528161 0.3493725 ] [ -1.2885674 1.4180187 -0.9236646 ] [ -0.2430877 -0.2786679 -0.1758597 ] [ 1.3977018 -0.8937436 -0.2648578 ] [ 0.2260202 -0.4869271 0.9984447 ] [ 0.3976699 -0.0609909 0.833751 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.828087609317129e-18 "source-value" -36.376062 } }