{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0755066 8.6430201 -2.6621935 ] [ -1.4723241 5.5060556 -12.4690656 ] [ -2.3483383 2.1526741 4.0231203 ] [ 0.5651246 3.5642039 -7.2357536 ] [ 5.1931292 -9.3852248 10.2303952 ] [ 4.2408342 -5.1958579 -1.6399658 ] [ -2.9254733 -3.6399518 7.6884409 ] [ -2.1774457 -1.6449192 2.065022 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.723151544232784e-09 1.384764485141234e-08 -4.265304220886678e-09 ] [ -2.358923270695079e-09 8.821673627824848e-09 -1.997764555213319e-08 ] [ -3.762452752987282e-09 3.448964143636979e-09 6.44574934043107e-09 ] [ 9.054294294185962e-10 5.710484207391672e-09 -1.159295534730138e-08 ] [ 8.320310261583111e-09 -1.503678787939732e-08 1.639090014602576e-08 ] [ 6.794565463908082e-09 -8.324682120964308e-09 -2.627514885319117e-09 ] [ -4.687124964650873e-09 -5.83184572284624e-09 1.231824036186993e-08 ] [ -3.488652622343773e-09 -2.635451107057973e-09 3.308529997095948e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.929535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.474804837548519e-18 } }