{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3745687 -2.9790986 -7.11143 ] [ -10.2424639 -16.9242289 21.9360415 ] [ -5.316692 -3.9536818 0.8617838 ] [ -3.7075304 9.826251 -0.4780346 ] [ 19.6412551 14.0307583 -15.2083607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.001252140234489e-10 -4.77304212797801e-09 -1.139376688645574e-08 ] [ -1.641023619996799e-08 -2.71156038686477e-08 3.514541284419856e-08 ] [ -8.518279622394393e-09 -6.334496546042461e-09 1.380729856544183e-09 ] [ -5.940118527785273e-09 1.574338962231262e-08 -7.658958600534797e-10 ] [ 3.146875972438877e-08 2.247975292035555e-08 -2.436647995423352e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.3807171 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.814329278358776e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0798507 2.070664 1.6823758 ] [ 2.5582559 1.8384128 5.1534801 ] [ 0.4187945 2.4208406 3.4693689 ] [ 1.2941165 4.721392 3.5972652 ] [ 3.4134168 3.5520076 3.132306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0798507e-10 2.070664e-10 1.6823758e-10 ] [ 2.5582559e-10 1.8384128e-10 5.1534801e-10 ] [ 4.187945e-11 2.4208406e-10 3.4693689e-10 ] [ 1.2941165e-10 4.721392e-10 3.5972652e-10 ] [ 3.4134168e-10 3.5520076e-10 3.132306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 8.3e-06 6.7e-06 ] [ -3.8e-06 1.58e-05 -4.9e-06 ] [ 5.7e-06 3.2e-06 -5.2e-06 ] [ 7.9e-06 -2.03e-05 6.2e-06 ] [ -1e-05 -6.9e-06 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 1.329806595264e-14 1.073458335936e-14 ] [ -6.08827115904e-15 2.531439060864e-14 -7.850665441919999e-15 ] [ 9.13240673856e-15 5.126965186560001e-15 -8.33131842816e-15 ] [ 1.265719530432e-14 -3.252418540224e-14 9.93349504896e-15 ] [ -1.6021766208e-14 -1.105501868352e-14 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.892431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.905377491267717e-18 } }