{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0521982 -1.1267538 -0.4879649 ] [ 0.0404317 0.6073677 0.7339433 ] [ -1.2701076 -1.6185404 -1.722389 ] [ 0.3092838 3.0798802 -0.6015072 ] [ -0.8441711 -1.3829264 -0.2672712 ] [ 0.0755171 0.955553 1.8097845 ] [ 1.5450754 -2.6092231 -0.4941809 ] [ 1.196169 2.0946429 1.0295854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.685807356487843e-09 -1.805258595757559e-09 -7.8180595455101e-10 ] [ 6.477872447919936e-11 9.731103291690681e-10 1.175906796252801e-09 ] [ -2.034936702620398e-09 -2.593187588700281e-09 -2.759571387723091e-09 ] [ 4.955272735521831e-10 4.934512051304829e-09 -9.637207730828699e-10 ] [ -1.352511200375019e-09 -2.215692346367109e-09 -4.28215668053161e-10 ] [ 1.209917320906157e-10 1.530964676535303e-09 2.899594414586218e-09 ] [ 2.475483683253208e-09 -4.1804362492713e-09 -7.917650844259027e-10 ] [ 1.916474006325715e-09 3.355987883304712e-09 1.649577656997016e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.532844 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.449941923613356e-18 } }