{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1184142 -6.5324162 -3.3228896 ] [ -8.2218483 3.2966491 -1.8428539 ] [ -6.2052921 4.3202039 2.9950847 ] [ 8.90611 -2.4089164 -0.6225254 ] [ 3.4026161 1.3244795 2.7931841 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.394073732373802e-09 -1.046608459920307e-08 -5.323856074481605e-09 ] [ -1.317285323455262e-08 5.281814158517129e-09 -2.952577458455772e-09 ] [ -9.941974009764792e-09 6.921729742695672e-09 4.798654723190899e-09 ] [ 1.426916134183374e-08 -3.859509569339397e-09 -9.973956499515036e-10 ] [ 5.451592009892207e-09 2.122050107112003e-09 4.475174299480319e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.999773432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121487343714936e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0458519 -0.262029 1.4248047 ] [ 0.4920704 2.5410763 0.253258 ] [ 0.0020532 1.6424226 2.4048034 ] [ 2.545273 1.3686704 0.5476513 ] [ 2.2830673 2.2375917 2.7506199 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0458519e-10 -2.62029e-11 1.4248047e-10 ] [ 4.920704e-11 2.5410763e-10 2.53258e-11 ] [ 2.0532e-13 1.6424226e-10 2.4048034e-10 ] [ 2.545273e-10 1.3686704e-10 5.476513e-11 ] [ 2.2830673e-10 2.2375917e-10 2.7506199e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.08e-05 -3.06e-05 1.5e-06 ] [ -1.82e-05 2.04e-05 -2.96e-05 ] [ -1.72e-05 -6.7e-06 9e-06 ] [ 1.69e-05 1.1e-06 -8.9e-06 ] [ 2.93e-05 1.59e-05 2.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73035076472e-14 -4.90266050004e-14 2.403264951e-15 ] [ -2.915961473879999e-14 3.26844033336e-14 -4.74244283664e-14 ] [ -2.75574381048e-14 -1.07345834478e-14 1.4419589706e-14 ] [ 2.70767851146e-14 1.7623942974e-15 -1.42593720426e-14 ] [ 4.69437753762e-14 2.54746084806e-14 4.486094575199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }