{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.8260844 -14.6043216 1.9690334 ] [ -2.8941719 5.0748208 -11.0222108 ] [ -9.3856797 8.8094185 3.9600527 ] [ 3.4101074 -7.4539961 -5.9356932 ] [ 4.7112483 -4.679035 1.2707629 ] [ 15.5274706 13.89098 -1.6933452 ] [ 3.4571098 -1.0378667 11.4514003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.37540058036876e-08 -2.339870263016445e-08 3.154739279054335e-09 ] [ -4.636974554756316e-09 8.130759240509554e-09 -1.765952845328926e-08 ] [ -1.503751658565716e-08 1.4114244363543e-08 6.344703853075916e-09 ] [ 5.463594350697074e-09 -1.194261828295438e-08 -9.510028873281538e-09 ] [ 7.548251881043745e-09 -7.496640484904927e-09 2.035986608960008e-09 ] [ 2.487775037547935e-08 2.225580339600039e-08 -2.7130380903839e-09 ] [ 5.538900497098564e-09 -1.662845762246847e-09 1.834716583608211e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3975896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.045715244993224e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3971046 1.559829 2.6043083 ] [ 3.1430589 4.1802518 1.2296035 ] [ 1.84001 3.8444006 3.309533 ] [ 3.5148528 1.6058007 1.413262 ] [ 5.1402634 2.2614807 3.1639657 ] [ 5.4282708 4.3923798 2.0285842 ] [ 3.6197264 3.1815104 4.7766264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3971046e-10 1.559829e-10 2.6043083e-10 ] [ 3.1430589e-10 4.1802518e-10 1.2296035e-10 ] [ 1.84001e-10 3.8444006e-10 3.309533e-10 ] [ 3.5148528e-10 1.6058007e-10 1.413262e-10 ] [ 5.140263400000001e-10 2.2614807e-10 3.1639657e-10 ] [ 5.4282708e-10 4.3923798e-10 2.0285842e-10 ] [ 3.6197264e-10 3.1815104e-10 4.7766264e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 -6.7e-06 1.14e-05 ] [ 1.1e-05 -5e-07 -6.4e-06 ] [ 1.8e-06 -7e-06 2.5e-06 ] [ -7.1e-06 1.06e-05 -4.4e-06 ] [ 9.3e-06 -3.1e-06 -4.3e-06 ] [ 2.4e-06 2e-06 2.2e-06 ] [ -1.26e-05 4.6e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.69044777984e-15 -1.073458335936e-14 1.826481347712e-14 ] [ 1.76239428288e-14 -8.010883104e-16 -1.025393037312e-14 ] [ 2.88391791744e-15 -1.12152363456e-14 4.005441552e-15 ] [ -1.137545400768e-14 1.698307218048e-14 -7.04957713152e-15 ] [ 1.490024257344e-14 -4.96674752448e-15 -6.889359469440001e-15 ] [ 3.84522388992e-15 3.2043532416e-15 3.52478856576e-15 ] [ -2.018742542208e-14 7.370012455680001e-15 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }