{ "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" [ [ 2.5292094 -2.6293442 -0.8744088 ] [ 1.2117657 2.3380169 1.5983604 ] [ 1.5723454 -0.4130017 -0.5944894 ] [ -1.2345176 0.5930288 0.599424 ] [ -0.3143757 0.6066027 -0.4459923 ] [ -3.1845922 1.9186323 -2.3807679 ] [ 0.0182164 -2.0063398 1.1629629 ] [ -0.5980513 -0.4075949 0.9349111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.052240169787596e-09 -4.212673805276079e-09 -1.400957336381783e-09 ] [ 1.941462674427347e-09 3.745916016215292e-09 2.560855664492536e-09 ] [ 2.519175039702424e-09 -6.617016680906555e-10 -9.524770179934194e-10 ] [ -1.977915236686126e-09 9.501368788210792e-10 9.603831187464191e-10 ] [ -5.036853966876346e-10 9.718846640541561e-10 -7.145584361168199e-10 ] [ -5.102279169622037e-09 3.073987814971732e-09 -3.814410668931112e-09 ] [ 2.918589019514112e-11 -3.214510720940548e-09 1.863271969237768e-09 ] [ -9.58183810899047e-10 -6.530390195373139e-10 1.497892706946411e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.476713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.683996015143143e-18 } }