{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.202318 1.231726 2.757655 ] [ 0.8396636 2.003193 0.0963359 ] [ 2.588342 1.167443 0.9025235 ] [ 2.880528 2.949579 2.371797 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.202318e-10 1.231726e-10 2.757655e-10 ] [ 8.396636e-11 2.003193e-10 9.633590000000001e-12 ] [ 2.588342e-10 1.167443e-10 9.025235000000001e-11 ] [ 2.880528e-10 2.949579e-10 2.371797e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.569175 1.8577516 -3.3224053 ] [ -2.3961353 0.9635578 -1.7114957 ] [ 0.2982507 3.5211724 7.8425074 ] [ -2.4712903 -6.3424817 -2.8086064 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.320625361343841e-09 2.976446180773793e-09 -5.323080096482011e-09 ] [ -3.839031957933594e-09 1.543789779949482e-09 -2.742118397139731e-09 ] [ 4.778502986772345e-10 5.641540097086226e-09 1.2565082004731e-08 ] [ -3.959443541869819e-09 -1.016177589759184e-08 -4.499883511109253e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6394691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.433248924944018e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7110143 1.7177819 4.6354254 ] [ 1.1052381 1.7013409 -1.4777179 ] [ 2.2380842 1.9645578 0.3895275 ] [ 2.456515 1.9682604 2.5810764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7110143e-10 1.7177819e-10 4.6354254e-10 ] [ 1.1052381e-10 1.7013409e-10 -1.4777179e-10 ] [ 2.2380842e-10 1.9645578e-10 3.895275e-11 ] [ 2.456515e-10 1.9682604e-10 2.5810764e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0160927 0.0018006 0.1002187 ] [ -0.0035785 0.0015938 -0.1003053 ] [ 0.0208448 -0.0015705 0.269766 ] [ -0.033359 -0.0018239 -0.2696795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.578334770554816e-11 2.88487922341248e-12 1.60568058106969e-10 ] [ -5.733389037532801e-12 2.55354909823104e-12 -1.607068066023302e-10 ] [ 3.339705122525184e-11 -2.5162183829664e-12 4.322127782867328e-10 ] [ -5.34470098932672e-11 -2.92220993867712e-12 -4.320741900090336e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3913857 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.344448198465544e-18 } }