{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8636237 3.0494506 1.3597297 ] [ 7.2525792 -3.7843268 4.1579267 ] [ 6.3862223 -0.3593898 1.7684965 ] [ -5.6134869 1.4440993 -4.1404607 ] [ -7.1616909 -0.3498332 -3.1456921 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.383677701308793e-09 4.885758457604533e-09 2.178527135947398e-09 ] [ 1.161991283474037e-08 -6.063159924426878e-09 6.661732949740095e-09 ] [ 1.02318560642916e-08 -5.758059353139878e-10 2.833443746266627e-09 ] [ -8.993797472347067e-09 2.313702136573645e-09 -6.633749332881203e-09 ] [ -1.147429372537611e-08 -5.604945742196505e-10 -5.039954338855256e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.544656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.048569483437845e-18 } "relaxed-configuration-positions" { "source-value" [ [ 5.3916153 1.5646701 -0.1280171 ] [ 1.1718922 2.7100639 4.4076696 ] [ 2.2214759 2.9844633 2.4913176 ] [ 0.5612893 1.943717 6.3775467 ] [ 3.7298074 2.5100339 0.9616692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.3916153e-10 1.5646701e-10 -1.280171e-11 ] [ 1.1718922e-10 2.7100639e-10 4.4076696e-10 ] [ 2.2214759e-10 2.9844633e-10 2.4913176e-10 ] [ 5.612893e-11 1.943717e-10 6.3775467e-10 ] [ 3.7298074e-10 2.5100339e-10 9.616692000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0220533 0.0212288 0.0022246 ] [ 0.0738261 0.0486872 -0.1762053 ] [ -0.1718166 -0.0198713 0.278408 ] [ -0.0257244 -0.0088231 0.0499247 ] [ 0.1457683 -0.0412216 -0.154352 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.533328167148864e-11 3.401228704763904e-11 3.56420211063168e-12 ] [ 1.182824514248429e-10 7.800549357221376e-11 -2.823120121210503e-10 ] [ -2.752805395853453e-10 -3.183733228490304e-11 4.460587886436864e-10 ] [ -4.121503226410753e-11 -1.413616454298048e-11 7.998818714045376e-11 ] [ 2.335465623137606e-10 -6.604428379196927e-11 -2.472991657737216e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.167201 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.789182836197438e-18 } }