{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8850604 -0.5125235 0.559236 ] [ 0.8412474 -0.6053092 -0.2829905 ] [ 1.6193518 0.4528079 -0.5722268 ] [ 2.6386362 3.1843854 1.6703121 ] [ -3.2325084 -0.6803245 -0.6556669 ] [ -1.3362304 -0.8241262 1.5191462 ] [ 0.3545639 -1.0149099 -2.2378101 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.418023080875896e-09 -8.211531693105889e-10 8.959948447097088e-10 ] [ 1.347826916588786e-09 -9.698122485951513e-10 -4.534007630085024e-10 ] [ 2.594487594810397e-09 7.254782310935443e-10 -9.168084007551975e-10 ] [ 4.227561230436554e-09 5.101947839496857e-09 2.676134996059352e-09 ] [ -5.179049385019615e-09 -1.09000000845745e-09 -1.050494178212412e-09 ] [ -2.140877106882233e-09 -1.320395730228745e-09 2.433940525217161e-09 ] [ 5.68073991159669e-10 -1.626064913998466e-09 -3.58536702401011e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.070085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.657541055166877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0310117 2.074802 4.4470924 ] [ 2.5014759 3.8358606 2.9213639 ] [ 5.1821969 1.0868502 2.7717672 ] [ 4.8245006 3.3926184 2.6813847 ] [ 2.9760318 1.6582309 2.046916 ] [ 3.3593008 0.2268998 3.9240097 ] [ 3.8142103 3.672965 4.8766441 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0310117e-10 2.074802e-10 4.4470924e-10 ] [ 2.5014759e-10 3.8358606e-10 2.9213639e-10 ] [ 5.182196900000001e-10 1.0868502e-10 2.7717672e-10 ] [ 4.824500600000001e-10 3.3926184e-10 2.6813847e-10 ] [ 2.9760318e-10 1.6582309e-10 2.046916e-10 ] [ 3.3593008e-10 2.268998e-11 3.9240097e-10 ] [ 3.8142103e-10 3.672965e-10 4.8766441e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 -1.5e-05 1.69e-05 ] [ 2.18e-05 -4.16e-05 2.22e-05 ] [ -1.96e-05 2.3e-06 7e-07 ] [ 1.06e-05 2.79e-05 7.5e-06 ] [ 1.42e-05 -4.48e-05 3.7e-06 ] [ -3.59e-05 3.37e-05 -4.39e-05 ] [ 1.7e-06 3.75e-05 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.137545400768e-14 -2.4032649312e-14 2.707678489152e-14 ] [ 3.492745033344e-14 -6.665054742528e-14 3.556832098176e-14 ] [ -3.140266176767999e-14 3.68500622784e-15 1.12152363456e-15 ] [ 1.698307218048e-14 4.470072772032e-14 1.2016324656e-14 ] [ 2.275090801536e-14 -7.177751261183999e-14 5.928053496960001e-15 ] [ -5.751814068672e-14 5.399335212096e-14 -7.033555365312e-14 ] [ 2.72370025536e-15 6.008162327999999e-14 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.651308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.071098569534001e-18 } }