{ "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" [ [ -1.5516324 0.5950245 -0.3756624 ] [ -0.2772762 -1.1523766 2.1410308 ] [ -0.0434678 0.8881752 -1.3406402 ] [ 1.4922953 -0.244943 -0.953979 ] [ -0.0419843 0.4556759 0.5285215 ] [ -1.659771 -1.252995 1.1958226 ] [ 0.3083413 -0.4035434 -3.2102802 ] [ 1.7734951 1.1149824 2.015187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.485989175837341e-09 9.533343505575328e-10 -6.018775195523615e-10 ] [ -4.442454488043107e-10 -1.846310862088364e-09 3.430309520434326e-09 ] [ -6.96430934913852e-11 1.423013552338277e-09 -2.147942403041086e-09 ] [ 2.39092066068802e-09 -3.924419512618619e-10 -1.528442863126686e-09 ] [ -6.726626445484619e-11 7.300732796569206e-10 8.467847978666309e-10 ] [ -2.659246313990814e-09 -2.00751931151883e-09 1.915919028129129e-09 ] [ 4.940172261571841e-10 -6.465478062849155e-10 -5.143435925032846e-09 ] [ 2.841452409733493e-09 1.786398748601241e-09 3.228685524540558e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.81424407419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.135897868004043e-18 } }