{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2833664 -5.2544248 -5.935264 ] [ -12.3106703 8.3837973 -5.7665549 ] [ -6.4745621 -7.1169007 6.7430001 ] [ -0.7058925 0.1725903 0.0577273 ] [ 11.5963737 -7.8048901 3.9628257 ] [ 5.4521808 4.4725139 -6.0073691 ] [ 4.7259367 7.1473141 6.9456349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.658356262800261e-09 -8.418516570311716e-09 -9.50934121907589e-09 ] [ -1.972386814103692e-08 1.343232402758616e-08 -9.239039443339683e-09 ] [ -1.037339202653775e-08 -1.140253191409516e-08 1.080347711427206e-08 ] [ -1.130964460298064e-09 2.765201436368582e-10 9.248933044190785e-11 ] [ 1.857943882819999e-08 -1.250481244613337e-08 6.349146688845394e-09 ] [ 8.735356610134641e-09 7.165757206783029e-09 -9.624866324536338e-09 ] [ 7.571785292120704e-09 1.145125955253419e-08 1.112813385339255e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.277349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806830491240226e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1447871 2.4306918 0.7740104 ] [ 1.5217988 4.7817596 1.7122906 ] [ 1.9830813 2.8319 3.3447917 ] [ 4.4176807 3.1728557 1.0182146 ] [ 4.3716673 2.9936663 3.4573522 ] [ 3.7763996 5.5099168 1.3506586 ] [ 4.6861542 5.3669889 3.5630461 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1447871e-10 2.4306918e-10 7.740104e-11 ] [ 1.5217988e-10 4.7817596e-10 1.7122906e-10 ] [ 1.9830813e-10 2.8319e-10 3.3447917e-10 ] [ 4.4176807e-10 3.1728557e-10 1.0182146e-10 ] [ 4.371667300000001e-10 2.9936663e-10 3.4573522e-10 ] [ 3.7763996e-10 5.5099168e-10 1.3506586e-10 ] [ 4.6861542e-10 5.3669889e-10 3.5630461e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.15e-05 -2.27e-05 -1.61e-05 ] [ 2.2e-05 8.1e-06 5.6e-06 ] [ -2.23e-05 7.9e-06 -2.47e-05 ] [ -1.15e-05 -6.4e-06 1.78e-05 ] [ 5.01e-05 5.3e-06 2.2e-06 ] [ -9.5e-06 -1e-06 1.68e-05 ] [ -7.2e-06 8.9e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.44467973472e-14 -3.636940929216e-14 -2.579504359488e-14 ] [ 3.52478856576e-14 1.297763062848e-14 8.972189076479999e-15 ] [ -3.572853864384e-14 1.265719530432e-14 -3.957376253376001e-14 ] [ -1.84250311392e-14 -1.025393037312e-14 2.851874385024e-14 ] [ 8.026904870208e-14 8.491536090240001e-15 3.52478856576e-15 ] [ -1.52206778976e-14 -1.6021766208e-15 2.691656722944e-14 ] [ -1.153567166976e-14 1.425937192512e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }