{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5455898 -3.1625599 -5.9222102 ] [ -4.2847222 -2.0092756 12.6685383 ] [ -8.9309787 3.7703263 -0.5290421 ] [ 0.8488091 -19.5245025 -0.3186413 ] [ 5.3707576 1.7253931 -10.333063 ] [ 0.2720885 18.1381966 -1.14871 ] [ 12.2696356 1.062422 5.5831282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.88501432610695e-09 -5.066979533659586e-09 -9.488426725903292e-09 ] [ -6.864881735462742e-09 -3.219214391063892e-09 2.029723588396938e-08 ] [ -1.430900527400278e-08 6.040728650647366e-09 -8.476188840389356e-10 ] [ 1.359942095542289e-09 -3.128170143825115e-08 -5.105196412813191e-10 ] [ 8.604902262703919e-09 2.764384486509637e-09 -1.655539195985351e-08 ] [ 4.359338334885408e-10 2.906059453599405e-08 -1.840436306079168e-09 ] [ 1.965812330405538e-08 1.702187689823578e-09 8.945157472969187e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.9513739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.126445641019317e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2242087 2.3799223 1.6585103 ] [ 2.8292445 2.5860263 4.9208524 ] [ 1.362485 3.8962464 3.4926642 ] [ 2.625125 0.7677677 3.379687 ] [ 4.210133 3.775893 1.7815683 ] [ 2.8479709 5.555253 2.6190125 ] [ 4.901665 3.2152974 3.9721225 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2242087e-10 2.3799223e-10 1.6585103e-10 ] [ 2.8292445e-10 2.5860263e-10 4.9208524e-10 ] [ 1.362485e-10 3.8962464e-10 3.4926642e-10 ] [ 2.625125e-10 7.677677e-11 3.379687e-10 ] [ 4.210133e-10 3.775893e-10 1.7815683e-10 ] [ 2.8479709e-10 5.555253000000001e-10 2.6190125e-10 ] [ 4.901665000000001e-10 3.2152974e-10 3.9721225e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 -1.8e-06 2e-06 ] [ -1.26e-05 1.13e-05 -7.6e-06 ] [ 1.4e-05 -7.6e-06 -4.8e-06 ] [ -3.8e-06 -4e-07 2.2e-06 ] [ -5.6e-06 -1.9e-06 7.1e-06 ] [ -4.6e-06 1e-07 1.05e-05 ] [ 9.8e-06 4e-07 -9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 -2.88391791744e-15 3.2043532416e-15 ] [ -2.018742542208e-14 1.810459581504e-14 -1.217654231808e-14 ] [ 2.24304726912e-14 -1.217654231808e-14 -7.69044777984e-15 ] [ -6.08827115904e-15 -6.408706483200001e-16 3.52478856576e-15 ] [ -8.972189076479999e-15 -3.04413557952e-15 1.137545400768e-14 ] [ -7.370012455680001e-15 1.6021766208e-16 1.68228545184e-14 ] [ 1.570133088384e-14 6.408706483200001e-16 -1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }