{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1451643 0.5180665 0.6048043 ] [ -0.5481651 0.3551824 0.8954813 ] [ 1.0383454 0.4727609 -1.3590912 ] [ 0.4998093 -0.2317252 0.2003113 ] [ -0.1907064 0.108492 0.797107 ] [ -0.6541188 -1.2227766 -1.1386126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.325788476347974e-10 8.300340343196832e-10 9.690033096193095e-10 ] [ -8.782573075584939e-10 5.690649373996339e-10 1.434719203223591e-09 ] [ 1.663612724195224e-09 7.574464612083668e-10 -2.177504146175017e-09 ] [ 8.007827753184135e-10 -3.712646978902042e-10 3.209340817420551e-10 ] [ -3.055453355169331e-10 1.738233459438336e-10 1.277106199676026e-09 ] [ -1.048013848585751e-09 -1.959104080981313e-09 -1.824258487868302e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.463799 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.477573722655042e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2229656 0.8093318 2.9024886 ] [ 2.2479225 2.8495657 2.0881195 ] [ 2.4924476 2.4945742 4.452572 ] [ 5.3748307 1.8088002 2.8299895 ] [ 4.3997875 3.8490394 2.015644 ] [ 4.6443231 3.4940247 4.3800924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2229656e-10 8.093318000000001e-11 2.9024886e-10 ] [ 2.2479225e-10 2.8495657e-10 2.0881195e-10 ] [ 2.4924476e-10 2.4945742e-10 4.452572e-10 ] [ 5.3748307e-10 1.8088002e-10 2.8299895e-10 ] [ 4.399787500000001e-10 3.8490394e-10 2.015644e-10 ] [ 4.6443231e-10 3.4940247e-10 4.3800924e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 3.42e-05 -1.16e-05 ] [ 1.3e-06 3.5e-06 1.44e-05 ] [ 1.2e-05 -1.47e-05 -4.4e-06 ] [ 1.53e-05 -8.9e-06 1.17e-05 ] [ -7.7e-06 -2.18e-05 -2.3e-06 ] [ -1.55e-05 7.7e-06 -7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 5.479444043136e-14 -1.858524880128e-14 ] [ 2.08282960704e-15 5.6076181728e-15 2.307134333952e-14 ] [ 1.92261194496e-14 -2.355199632576e-14 -7.04957713152e-15 ] [ 2.451330229824e-14 -1.425937192512e-14 1.874546646336e-14 ] [ -1.233675998016e-14 -3.492745033344e-14 -3.68500622784e-15 ] [ -2.48337376224e-14 1.233675998016e-14 -1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }