{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.304566 2.573407 2.013286 ] [ 1.594988 1.205897 3.788304 ] [ 4.305804 2.27362 1.126873 ] [ 3.775257 0.6680547 2.70197 ] [ 5.174566 3.086819 3.056932 ] [ 3.543793 4.723705 1.740813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.304566e-10 2.573407e-10 2.013286e-10 ] [ 1.594988e-10 1.205897e-10 3.788304e-10 ] [ 4.305804000000001e-10 2.27362e-10 1.126873e-10 ] [ 3.775257e-10 6.680547000000001e-11 2.70197e-10 ] [ 5.174566e-10 3.086819000000001e-10 3.056932e-10 ] [ 3.543793e-10 4.723705e-10 1.740813e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5364946 1.362609 -1.5290125 ] [ -0.6014348 -0.3288555 0.644172 ] [ 1.285314 -1.3073983 -2.1757532 ] [ 0.7385171 -3.7094225 1.0429046 ] [ 3.9691359 1.3072235 2.1181372 ] [ -0.8550377 2.6758438 -0.1004481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.268265588505448e-09 2.183140283091667e-09 -2.44974808041096e-09 ] [ -9.63604775495524e-10 -5.268845937214945e-10 1.032077318173978e-09 ] [ 2.059300041186931e-09 -2.094682990333665e-09 -3.485940909670786e-09 ] [ 1.183234831681016e-09 -5.943150006169488e-09 1.670917367844776e-09 ] [ 6.359256743757967e-09 2.094402929860349e-09 3.393629901486774e-09 ] [ -1.369921412842604e-09 4.287174377272631e-09 -1.609355974237805e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.976291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079031006489745e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1679814 2.8639303 1.602346 ] [ 1.6342473 1.3675845 3.4058178 ] [ 4.3601518 1.7211914 1.3264743 ] [ 3.7964006 0.2404919 3.1337211 ] [ 5.4511737 3.6056068 2.3438608 ] [ 3.2890192 4.7326977 2.615958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1679814e-10 2.8639303e-10 1.602346e-10 ] [ 1.6342473e-10 1.3675845e-10 3.4058178e-10 ] [ 4.3601518e-10 1.7211914e-10 1.3264743e-10 ] [ 3.7964006e-10 2.404919e-11 3.1337211e-10 ] [ 5.4511737e-10 3.6056068e-10 2.3438608e-10 ] [ 3.2890192e-10 4.732697700000001e-10 2.615958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.43e-05 -4.1e-06 4.6e-06 ] [ -1.53e-05 1e-06 1.1e-06 ] [ 1.34e-05 -1.33e-05 -1.3e-05 ] [ 7e-06 -5.5e-06 1.1e-06 ] [ 1.56e-05 1.2e-06 2.3e-06 ] [ -6.5e-06 2.07e-05 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.291112567744e-14 -6.568924145279999e-15 7.370012455680001e-15 ] [ -2.451330229824e-14 1.6021766208e-15 1.76239428288e-15 ] [ 2.146916671872e-14 -2.130894905664e-14 -2.08282960704e-14 ] [ 1.12152363456e-14 -8.8119714144e-15 1.76239428288e-15 ] [ 2.499395528448e-14 1.92261194496e-15 3.68500622784e-15 ] [ -1.04141480352e-14 3.316505605055999e-14 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.235572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.76144305045151e-18 } }