{ "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" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.3424327 3.7934815 -6.522732 ] [ 0.6072424 0.2473663 -0.2346885 ] [ 17.0273867 -7.4638956 -23.3578868 ] [ -9.1663962 -14.0565402 28.5584992 ] [ 3.8741998 17.479588 1.556808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.977475711573742e-08 6.077827370737316e-09 -1.045056871414403e-08 ] [ 9.72909576438482e-10 3.963245026337991e-10 -3.760124278706208e-10 ] [ 2.728088088406086e-08 -1.195847903041199e-08 -3.742346014225292e-08 ] [ -1.468618568862996e-08 -2.252106007777536e-08 4.57557597433755e-08 ] [ 6.207152343868036e-09 2.800538723481623e-08 2.494281380674406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.0531512 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.891687472407465e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.697375 0.4004289 -0.2174358 ] [ 1.4439419 3.6694062 3.1396166 ] [ 3.3196248 0.5583893 0.083739 ] [ 1.8525306 -0.6647664 1.8908678 ] [ 1.7258222 1.9363344 1.6299483 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.97375e-11 4.004289e-11 -2.174358e-11 ] [ 1.4439419e-10 3.6694062e-10 3.1396166e-10 ] [ 3.3196248e-10 5.583893e-11 8.3739e-12 ] [ 1.8525306e-10 -6.647664e-11 1.8908678e-10 ] [ 1.7258222e-10 1.9363344e-10 1.6299483e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.47e-05 -1.38e-05 1.6e-06 ] [ 1.31e-05 6.6e-06 1.75e-05 ] [ 1.5e-05 6.2e-06 1.98e-05 ] [ -1.8e-06 5.35e-05 -1.51e-05 ] [ -1.17e-05 -5.24e-05 -2.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.355199632576e-14 -2.211003736704e-14 2.56348259328e-15 ] [ 2.098851373248e-14 1.057436569728e-14 2.8038090864e-14 ] [ 2.4032649312e-14 9.93349504896e-15 3.172309709184e-14 ] [ -2.88391791744e-15 8.57164492128e-14 -2.419286697408e-14 ] [ -1.874546646336e-14 -8.395405492992e-14 -3.813180357504e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.6041367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.538752328370726e-18 } }