{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0064424999999995 2.0361433999999994 -5.872122599999999 ] [ 0.6979472999999999 0.17939419999999998 -0.6931292999999998 ] [ -0.33605879999999994 3.9631062999999997 1.6442831999999998 ] [ -3.7915727999999995 0.12685359999999998 -1.1150502999999998 ] [ 1.3948874999999998 -1.4591553999999998 -0.46392049999999996 ] [ 4.532012999999999 -4.342494199999999 3.2073040999999995 ] [ 0.5939448999999999 0.43547359999999996 1.3826894999999997 ] [ -0.08471859999999999 -0.9393213999999999 1.9099458999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.816851924964544e-09 3.262261378953314e-09 -9.408177621703326e-09 ] [ 1.118234855823388e-09 2.874211955151227e-10 -1.110515568800776e-09 ] [ -5.38425557010079e-10 6.349596311918194e-09 2.634432122718748e-09 ] [ -6.074769346269954e-09 2.032418738587824e-10 -1.78650753639469e-09 ] [ 2.234856159558674e-09 -2.337824687254923e-09 -7.432825851335969e-10 ] [ 7.26108533358424e-09 -6.95744274052052e-09 5.138667687152397e-09 ] [ 9.516046406634664e-10 6.977056266438622e-10 2.215312808977142e-09 ] [ -1.357341613851924e-10 -1.504958798896167e-09 3.0600706931841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.0996123984375217 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.363949925233295e-19 } }