{ "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" [ 5.43385 0 0 ] "si-unit" "m" "si-value" [ 5.43385e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0231251 5.41563 0 ] "si-unit" "m" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0358168 0.0829392 5.41654 ] "si-unit" "m" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4421672 -2.6081581 -1.501238 ] [ 0.9555993 2.3407285 1.381715 ] [ 1.5355983 -0.6556544 -0.782003 ] [ -1.7368379 1.2045756 1.1147132 ] [ -0.0653569 0.6664129 -0.3248263 ] [ -2.5668498 1.3953838 -1.585777 ] [ -0.0376056 -2.2416576 0.9606545 ] [ -0.5267147 -0.1016306 0.7367616 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.912783224161205e-09 -4.178729965597834e-09 -2.405248445672892e-09 ] [ 1.531038869926756e-09 3.750260509237869e-09 2.21375148784731e-09 ] [ 2.460299715470122e-09 -1.050474159659289e-09 -1.252906934317902e-09 ] [ -2.782721100425629e-09 1.929942880206531e-09 1.785967442651369e-09 ] [ -1.047132980506746e-10 1.067711176976179e-09 -5.204291079686742e-10 ] [ -4.112546772547572e-09 2.235651319822129e-09 -2.540694856134618e-09 ] [ -6.02508136275504e-11 -3.591531428148518e-09 1.539138193246953e-09 ] [ -8.438899851243197e-10 -1.628301726194004e-10 1.180422220348454e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.49968729230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.527459286003536e-18 } }