{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7655143 -4.7110516 1.9135268 ] [ -5.0162091 7.208811 -5.8670167 ] [ -2.6678443 2.1058975 5.160671 ] [ 3.4552759 -4.0577757 -5.9412261 ] [ 6.9942918 -0.5458811 4.734045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.430842392452866e-09 -7.547936795088315e-09 3.065807927492791e-09 ] [ -8.036853011278168e-09 1.154978854312217e-08 -9.399997068027787e-09 ] [ -4.274357800610086e-09 3.374019768099015e-09 8.268306491961413e-09 ] [ 5.535962311003321e-09 -6.501273412552993e-09 -9.518893634730946e-09 ] [ 1.12060908933378e-08 -8.745979433622173e-10 7.584776283304529e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.149936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.106852019779542e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5753891 1.8877175 2.2332468 ] [ 2.8458081 4.1962873 1.1141449 ] [ 2.5118418 4.0218622 3.6469577 ] [ 4.2533725 2.2078007 0.3256042 ] [ 4.7265844 3.2604304 2.6114618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5753891e-10 1.8877175e-10 2.2332468e-10 ] [ 2.8458081e-10 4.1962873e-10 1.1141449e-10 ] [ 2.5118418e-10 4.021862200000001e-10 3.6469577e-10 ] [ 4.253372500000001e-10 2.2078007e-10 3.256042000000001e-11 ] [ 4.726584400000001e-10 3.2604304e-10 2.6114618e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.22e-05 -7.82e-05 3.89e-05 ] [ 3.7e-06 0.0001321 -9.1e-05 ] [ -4.5e-05 -3.24e-05 6.75e-05 ] [ 5e-07 -7.41e-05 -5.21e-05 ] [ 8.3e-05 5.26e-05 3.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.761185395480001e-14 -1.252902127788e-13 6.232467106259999e-14 ] [ 5.9280535458e-15 2.116475333514e-13 -1.45798073694e-13 ] [ -7.209794852999999e-14 -5.19105229416e-14 1.08146922795e-13 ] [ 8.010883169999999e-16 -1.187212885794e-13 -8.347340263139999e-14 ] [ 1.32980660622e-13 8.42744909484e-14 5.879988246779999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }