{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3366759 0.667903 -1.6378813 ] [ 0.2786621 -1.431927 3.6778393 ] [ -0.4685785 0.5486487 -2.0695702 ] [ 2.2406705 -0.0107587 -1.2608206 ] [ -0.1331288 0.5401469 0.5281092 ] [ -2.4955045 -1.4935464 2.0791511 ] [ 0.2830353 -0.4332656 -5.2644243 ] [ 2.6315198 1.6127989 3.9475968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.743767497366799e-09 1.070098571562183e-09 -2.624175126505511e-09 ] [ 4.464659017230317e-10 -2.294199962092282e-09 5.892548141519438e-09 ] [ -7.507455177095328e-10 8.79032120172313e-10 -3.31581698954438e-09 ] [ 3.589949890016246e-09 -1.723733761020096e-11 -2.020057288343028e-09 ] [ -2.13295850915159e-10 8.654107349775955e-10 8.461242134693913e-10 ] [ -3.998238967001193e-09 -2.392925124160005e-09 3.331167283530603e-09 ] [ 4.534725405211142e-10 -6.941680149168845e-10 -8.434537535431405e-09 ] [ 4.216159500732292e-09 2.583988691631957e-09 6.324747301304894e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.543611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.694714256300971e-18 } }