{ "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" [ [ -1.6534316 0.670752 -0.4600424 ] [ -0.1946022 -1.1669771 2.1657166 ] [ -0.0210892 0.8224996 -1.4011891 ] [ 1.5294395 -0.3423966 -1.1820387 ] [ -0.0426568 0.5286279 0.6856098 ] [ -1.9527719 -1.2991604 1.4212349 ] [ 0.3476683 -0.2145274 -3.4499025 ] [ 1.987444 1.0011819 2.2206116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.649089475437234e-09 1.074663181608768e-09 -7.370691839292815e-10 ] [ -3.117870977649948e-10 -1.869703442033081e-09 3.469860532385924e-09 ] [ -3.378862346975279e-11 1.317789640594346e-09 -2.244952435835489e-09 ] [ 2.450432230016643e-09 -5.485798320810444e-10 -1.893834785623736e-09 ] [ -6.83437282412112e-11 8.469552694604886e-10 1.098468001601413e-09 ] [ -3.128685509711784e-09 -2.081484436698094e-09 2.277069348205327e-09 ] [ 5.570260266425021e-10 -3.437107876327716e-10 -5.527353175078184e-09 ] [ 3.184236338183496e-09 1.604070246563724e-09 3.557812018709354e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.986994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.76575209146982e-18 } }