{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4970059 -2.7072616 1.0805047 ] [ 0.6750013 -8.6301678 -1.1952211 ] [ -1.0004395 -0.762563 1.1303497 ] [ 0.8963255 2.1282722 -1.7564632 ] [ 6.2451654 2.88444 1.048864 ] [ -2.8823668 2.255209 -7.2416957 ] [ -1.43668 4.8320713 6.9336615 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.000644474979663e-09 -4.337511241909601e-09 1.731159369004518e-09 ] [ 1.081471301869607e-09 -1.382705308274097e-08 -1.914955303106859e-09 ] [ -1.602880777424841e-09 -1.22176061048711e-09 1.811019862668294e-09 ] [ 1.43607176072687e-09 3.409867961538582e-09 -2.814164274335555e-09 ] [ 1.000585799690908e-08 4.621382332100352e-09 1.680465379198771e-09 ] [ -4.618060699530109e-09 3.613243134817747e-09 -1.160247554548789e-08 ] [ -2.301815107570944e-09 7.741831666898664e-09 1.110895035184106e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6939385 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.553140162817302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2411462 2.8869099 2.7544484 ] [ 4.7649649 1.2421813 1.478826 ] [ 5.0457248 2.4037358 4.367711 ] [ 3.4945215 1.0606515 3.3668872 ] [ 5.520767 3.501962 2.1883544 ] [ 3.4619995 3.1406354 0.8421404 ] [ 3.7428121 4.3022266 3.7310007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2411462e-10 2.8869099e-10 2.7544484e-10 ] [ 4.7649649e-10 1.2421813e-10 1.478826e-10 ] [ 5.0457248e-10 2.4037358e-10 4.367711e-10 ] [ 3.4945215e-10 1.0606515e-10 3.3668872e-10 ] [ 5.520767e-10 3.501962e-10 2.1883544e-10 ] [ 3.4619995e-10 3.1406354e-10 8.421404e-11 ] [ 3.7428121e-10 4.3022266e-10 3.7310007e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.67e-05 2.01e-05 -3.87e-05 ] [ 3.6e-06 -2.54e-05 -1.88e-05 ] [ 1.24e-05 3.68e-05 -1.42e-05 ] [ -7.9e-06 -1.48e-05 3.08e-05 ] [ -1.64e-05 4.9e-06 2.68e-05 ] [ -1.53e-05 2.02e-05 1.51e-05 ] [ 7e-06 -4.18e-05 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.675634956736e-14 3.220375007808e-14 -6.200423522496e-14 ] [ 5.76783583488e-15 -4.069528616832e-14 -3.012092047104e-14 ] [ 1.986699009792e-14 5.896009964544001e-14 -2.275090801536e-14 ] [ -1.265719530432e-14 -2.371221398784e-14 4.934703992064001e-14 ] [ -2.627569658112e-14 7.850665441919999e-15 4.293833343744e-14 ] [ -2.451330229824e-14 3.236396774016e-14 2.419286697408e-14 ] [ 1.12152363456e-14 -6.697098274944e-14 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }