{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1856208 -5.5303282 2.3856201 ] [ 6.0664503 -2.175907 -4.0185702 ] [ 3.4497656 3.1000088 -1.9506847 ] [ -6.2845214 6.9698463 2.002223 ] [ 0.0 0.0 0.0 ] [ -0.7140972 7.5320225 -7.2391437 ] [ -5.7032181 -9.8956424 8.8205555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.103927168494192e-09 -8.860562547390946e-09 3.822184750330558e-09 ] [ 9.719524841905146e-09 -3.486187324435066e-09 -6.43845922348358e-09 ] [ 5.527133791560084e-09 4.966761623634263e-09 -3.125341420892262e-09 ] [ -1.006891325999729e-08 1.116692479242938e-08 3.207914880228039e-09 ] [ 0.0 0.0 0.0 ] [ -1.144109838818742e-09 1.206763035683957e-08 -1.159838679075161e-08 ] [ -9.137562703143397e-09 -1.58545669010772e-08 1.413208780456885e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7452778 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.20494977116126e-19 } "relaxed-configuration-positions" { "source-value" [ [ 4.0889982 1.0115092 0.8348982 ] [ 1.5083914 2.7153208 5.5662319 ] [ 1.5136198 1.3300177 3.8492575 ] [ 3.4950337 0.8986552 2.9487468 ] [ 4.9148786 2.2794384 -0.7629921 ] [ 4.6962256 1.7931719 4.5853862 ] [ 3.6378587 3.0306964 6.0748234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.0889982e-10 1.0115092e-10 8.348982e-11 ] [ 1.5083914e-10 2.715320800000001e-10 5.5662319e-10 ] [ 1.5136198e-10 1.3300177e-10 3.8492575e-10 ] [ 3.4950337e-10 8.986552000000001e-11 2.9487468e-10 ] [ 4.9148786e-10 2.2794384e-10 -7.629921e-11 ] [ 4.6962256e-10 1.7931719e-10 4.585386200000001e-10 ] [ 3.6378587e-10 3.0306964e-10 6.0748234e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1964933 -0.02462 -0.6024719 ] [ 0.07865 0.1308298 0.2739142 ] [ 0.2273966 -0.2142267 -0.3017689 ] [ -0.2903426 0.3421331 0.7609946 ] [ -0.0095515 -0.0817312 -0.0624903 ] [ 0.011875 -0.1973925 -0.2058724 ] [ -0.2145209 0.0450076 0.1376947 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.148169714038407e-10 -3.9445588404096e-11 -9.652663928689556e-10 ] [ 1.2601119122592e-10 2.096124468639398e-10 4.388589273451354e-10 ] [ 3.643295161694093e-10 -3.432290102911354e-10 -4.834870764645331e-10 ] [ -4.651801257422861e-10 5.481576540218285e-10 1.219247756675048e-09 ] [ -1.53031899935712e-11 -1.30947817829929e-10 -1.001204976867783e-10 ] [ 1.9025847372e-11 -3.16257648621264e-10 -3.29843946147986e-10 ] [ -3.437003706529747e-10 7.211012447831809e-11 2.206112291480698e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.326485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.615791256684189e-18 } }