{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.1241328 -9.9686122 -1.1593366 ] [ -18.557641 3.5441668 -27.9989236 ] [ -14.6637161 -6.4912987 14.8279279 ] [ 18.1659143 -1.3879513 -2.1574016 ] [ 5.7712273 -2.5938541 2.5230405 ] [ 2.1575597 -0.2770251 -0.9661439 ] [ 24.2507886 17.1745746 14.9308373 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.743588522363445e-08 -1.597147740866166e-08 -1.857461996157761e-09 ] [ -2.973261854739954e-08 5.67838118717555e-09 -4.485922079948538e-08 ] [ -2.349386310946855e-08 -1.040020701576943e-08 2.375695941628804e-08 ] [ 2.91050031869164e-08 -2.223743123668967e-09 -3.456538405196513e-09 ] [ 9.246525453382709e-09 -4.155812396786225e-09 4.042356502431542e-09 ] [ 3.456791709320262e-09 -4.438431385947821e-10 -1.547933168908533e-09 ] [ 3.885404653088317e-08 2.751670189630551e-08 2.39218384510286e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6215089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.381317999559913e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9135785 1.5822185 2.6461103 ] [ 1.7586817 4.0922508 2.331183 ] [ 1.6431373 2.9900443 4.7361606 ] [ 4.3763728 1.6469054 2.7940431 ] [ 4.1154064 2.5481312 5.0768294 ] [ 4.2645865 3.9712712 1.9716959 ] [ 3.4640098 4.8403645 4.2138277 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9135785e-10 1.5822185e-10 2.6461103e-10 ] [ 1.7586817e-10 4.0922508e-10 2.331183e-10 ] [ 1.6431373e-10 2.9900443e-10 4.7361606e-10 ] [ 4.3763728e-10 1.6469054e-10 2.7940431e-10 ] [ 4.115406400000001e-10 2.5481312e-10 5.0768294e-10 ] [ 4.2645865e-10 3.9712712e-10 1.9716959e-10 ] [ 3.4640098e-10 4.8403645e-10 4.2138277e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 1.93e-05 -1.77e-05 ] [ -1e-06 1.3e-05 -8.9e-06 ] [ 2.81e-05 -4.31e-05 2.54e-05 ] [ 5.3e-06 1.5e-06 7.5e-06 ] [ -2.94e-05 -3.5e-06 2.94e-05 ] [ -1.4e-06 -1.87e-05 -3.84e-05 ] [ 1.5e-06 3.15e-05 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 3.092200878144e-14 -2.835852618816e-14 ] [ -1.6021766208e-15 2.08282960704e-14 -1.425937192512e-14 ] [ 4.502116304448e-14 -6.905381235648e-14 4.069528616832e-14 ] [ 8.491536090240001e-15 2.4032649312e-15 1.2016324656e-14 ] [ -4.710399265152e-14 -5.6076181728e-15 4.710399265152e-14 ] [ -2.24304726912e-15 -2.996070280896e-14 -6.152358223872e-14 ] [ 2.4032649312e-15 5.04685635552e-14 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }