{ "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" [ [ 2.082752 2.058358 1.918508 ] [ 1.804708 3.969119 3.022657 ] [ 3.997636 1.573064 0.3548062 ] [ 3.986466 2.315414 3.180743 ] [ 3.658552 3.790773 1.50531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082752e-10 2.058358e-10 1.918508e-10 ] [ 1.804708e-10 3.969119e-10 3.022657e-10 ] [ 3.997636e-10 1.573064e-10 3.548062000000001e-11 ] [ 3.986466e-10 2.315414e-10 3.180743e-10 ] [ 3.658552e-10 3.790773e-10 1.50531e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7185383 -7.2284462 -1.7394696 ] [ -5.6532504 5.4506636 3.2608131 ] [ 1.4351676 -2.1660134 -3.9932798 ] [ 6.6756687 -3.7197554 7.3930444 ] [ 5.2609525 7.6635514 -4.9211081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.236646161100938e-08 -1.15812475063506e-08 -2.786937525712328e-09 ] [ -9.057505622408249e-09 8.732925787765563e-09 5.224398513618373e-09 ] [ 2.299391975649646e-09 -3.470336029819519e-09 -6.397939535872899e-09 ] [ 1.069560031934633e-08 -5.959705136974553e-09 1.184496289421636e-08 ] [ 8.428975098639312e-09 1.227836288537911e-08 -7.884484346249508e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.79846304 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.279278815260895e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0616557 1.5092138 2.2794967 ] [ 1.7122607 3.9932921 2.3035984 ] [ 3.4158321 2.0764287 0.2453437 ] [ 4.1899755 2.1543156 3.4402726 ] [ 4.1503899 3.9734778 1.7133128 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0616557e-10 1.5092138e-10 2.2794967e-10 ] [ 1.7122607e-10 3.9932921e-10 2.3035984e-10 ] [ 3.4158321e-10 2.0764287e-10 2.453437e-11 ] [ 4.1899755e-10 2.1543156e-10 3.4402726e-10 ] [ 4.1503899e-10 3.9734778e-10 1.7133128e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 6.1e-06 -2.3e-06 ] [ 6e-07 -3e-07 0.0 ] [ -2e-07 2e-07 2.1e-06 ] [ -3e-07 2.6e-06 -3.2e-06 ] [ -5.4e-06 -8.5e-06 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 9.77327738688e-15 -3.68500622784e-15 ] [ 9.6130597248e-16 -4.8065298624e-16 0.0 ] [ -3.2043532416e-16 3.2043532416e-16 3.36457090368e-15 ] [ -4.8065298624e-16 4.16565921408e-15 -5.126965186560001e-15 ] [ -8.65175375232e-15 -1.36185012768e-14 5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }