{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2092189 1.3021923 3.1133058 ] [ 0.04229 0.1909045 -0.7707366 ] [ 0.7520324 -0.5617721 0.034597 ] [ 3.356198 -3.4640412 -2.6949742 ] [ -3.173355 2.3725531 3.7277226 ] [ -0.3521031 1.0284879 0.8514234 ] [ -0.3170275 0.259346 -0.9384025 ] [ 2.901184 -1.1276706 -3.3229356 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.141735492609493e-09 2.08634205884578e-09 4.98806576616104e-09 ] [ 6.775604929363201e-11 3.058627267055136e-10 -1.234856161314881e-09 ] [ 1.204888729364114e-09 -9.000581248377197e-10 5.54305045498176e-11 ] [ 5.377221970375719e-09 -5.550005824127978e-09 -4.317824656899183e-09 ] [ -5.084275190498784e-09 3.801249108426565e-09 5.972469998547791e-09 ] [ -5.641313549312045e-10 1.647819268155688e-09 1.364130665882047e-09 ] [ -5.07934048650672e-10 4.155180978979968e-10 -1.503486546400272e-09 ] [ 4.648209177439028e-09 -1.806727471283509e-09 -5.323929730744021e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.862115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.5855265604641e-18 } }