{ "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" [ [ -1.0596007 3.8474258 0.1490361 ] [ 1.8084015 0.0388482 -3.8352606 ] [ -3.2232334 0.5591796 3.0174455 ] [ 0.8626396 3.2426569 -5.1510356 ] [ 3.6320699 -3.125189 0.4825322 ] [ 4.750009 -5.7673504 0.6735229 ] [ -1.8852125 -1.213279 0.1902529 ] [ -4.8850734 2.4177079 4.4735066 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.697667468923315e-09 6.164255667022737e-09 2.387821550752109e-10 ] [ 2.897378604319651e-09 6.224167780016256e-11 -6.14476486799538e-09 ] [ -5.164189196861694e-09 8.959044819482957e-10 4.834480634638167e-09 ] [ 1.382100999296264e-09 5.195309074455804e-09 -8.252868811228501e-09 ] [ 5.819217478891394e-09 -5.007104751381332e-09 7.731018096231898e-10 ] [ 7.610353368389589e-09 -9.240313974841528e-09 1.079102643953416e-09 ] [ -3.02044339273992e-09 -1.943887248307603e-09 3.048187484194003e-10 ] [ -7.826750392371966e-09 3.873595073303464e-09 7.167347687514498e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -219.51195 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.516969142762186e-17 } }