{ "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" [ [ -9.1586262 -3.4531918 1.547403 ] [ 4.4566098 -18.2548186 -7.1322979 ] [ 2.5492053 -2.2911733 5.7353604 ] [ -0.705889 -1.2034504 0.7224809 ] [ 12.7940816 6.365957 0.3171349 ] [ -4.7211921 4.9200246 -14.3210565 ] [ -5.2141895 13.9166525 13.1309752 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.467373677628635e-08 -5.53262316909827e-09 2.479212909555783e-09 ] [ 7.140276029588164e-09 -2.924744357786499e-08 -1.142720094796094e-08 ] [ 4.084277133279451e-09 -3.670864295461185e-09 9.189060344742136e-09 ] [ -1.130958852679891e-09 -1.928140095172408e-09 1.157542006954543e-09 ] [ 2.049837842412746e-08 1.01993874744181e-08 5.08106122419746e-10 ] [ -7.564183604925655e-09 7.88274838788087e-09 -2.294486190945587e-08 ] [ -8.354052513320842e-09 2.229693527529787e-08 2.10381414737446e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3322062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.543136110924809e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1717455 2.9124054 2.745792 ] [ 4.7931596 1.1421238 1.3853838 ] [ 5.0886041 2.4021921 4.5030315 ] [ 3.4994267 0.9901817 3.3968645 ] [ 5.5972196 3.5509612 2.1631913 ] [ 3.4132561 3.1402478 0.7087365 ] [ 3.7085244 4.4001904 3.8263685 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1717455e-10 2.9124054e-10 2.745792e-10 ] [ 4.7931596e-10 1.1421238e-10 1.3853838e-10 ] [ 5.088604100000001e-10 2.4021921e-10 4.5030315e-10 ] [ 3.4994267e-10 9.901817000000001e-11 3.3968645e-10 ] [ 5.597219600000001e-10 3.5509612e-10 2.1631913e-10 ] [ 3.4132561e-10 3.1402478e-10 7.087365e-11 ] [ 3.7085244e-10 4.4001904e-10 3.8263685e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.02e-05 -4.27e-05 -7e-07 ] [ 5.8e-06 2.19e-05 4.58e-05 ] [ 2.33e-05 -4.33e-05 4.06e-05 ] [ -3.06e-05 7.7e-06 -3.37e-05 ] [ -1e-06 1.03e-05 -5.68e-05 ] [ 6.6e-06 2.5e-06 -1.1e-06 ] [ 6.1e-06 4.37e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.634220153216e-14 -6.841294170816001e-14 -1.12152363456e-15 ] [ 9.292624400640001e-15 3.508766799552e-14 7.337968923264e-14 ] [ 3.733071526464e-14 -6.937424768064e-14 6.504837080448e-14 ] [ -4.902660459647999e-14 1.233675998016e-14 -5.399335212096e-14 ] [ -1.6021766208e-15 1.650241919424e-14 -9.100363206143999e-14 ] [ 1.057436569728e-14 4.005441552e-15 -1.76239428288e-15 ] [ 9.77327738688e-15 7.001511832895999e-14 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }