{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.936996 -1.3958273 -5.0452909 ] [ -3.7329644 -2.0453377 8.2883104 ] [ 6.5352515 -6.5076873 -3.420136 ] [ -0.0893165 8.9971785 0.1503892 ] [ 2.2240253 0.9516738 0.0267273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.909939568183116e-09 -2.236361866734388e-09 -8.08344712511499e-09 ] [ -5.9808682879587e-09 -3.276992244580844e-09 1.32793371488135e-08 ] [ 1.047062716434813e-08 -1.042646444753708e-08 -5.479661939156428e-09 ] [ -1.431008081516832e-10 1.441506904586441e-08 2.409500602608154e-10 ] [ 3.563281339727707e-09 1.524749512987895e-09 4.282185519710784e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -1.975768 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.165529297724774e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3784882 2.1114114 -0.1994024 ] [ 1.5642361 1.6958687 3.0572545 ] [ 2.9440718 0.7345441 1.1957611 ] [ 1.7675005 3.7620922 1.6491723 ] [ 4.1246696 2.9376766 1.4095223 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3784882e-10 2.1114114e-10 -1.994024e-11 ] [ 1.5642361e-10 1.6958687e-10 3.0572545e-10 ] [ 2.9440718e-10 7.345441e-11 1.1957611e-10 ] [ 1.7675005e-10 3.7620922e-10 1.6491723e-10 ] [ 4.1246696e-10 2.9376766e-10 1.4095223e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.7e-05 -6.8e-06 -1.8e-06 ] [ -2.57e-05 4.7e-06 1.65e-05 ] [ 2.57e-05 -4.36e-05 -2.47e-05 ] [ 7.4e-06 2.31e-05 -2.4e-06 ] [ 1.95e-05 2.26e-05 1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.32587687616e-14 -1.089480102144e-14 -2.88391791744e-15 ] [ -4.117593915456e-14 7.53023011776e-15 2.64359142432e-14 ] [ 4.117593915456e-14 -6.985490066688e-14 -3.957376253376001e-14 ] [ 1.185610699392e-14 3.701027994048e-14 -3.84522388992e-15 ] [ 3.12424441056e-14 3.620919163008e-14 1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }