{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7411356 15.509367 -26.5692781 ] [ 2.3318222 -14.7535724 28.5598333 ] [ -0.7817596 -3.9851291 1.2207363 ] [ 8.2328589 0.6918359 -12.1293214 ] [ 1.9582141 2.5374986 8.9180299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.881137295996258e-08 2.484874521080703e-08 -4.256867620335344e-08 ] [ 3.735991012702422e-09 -2.363782877256014e-08 4.575789720720531e-08 ] [ -1.25251695420596e-09 -6.384880674889745e-09 1.955835160021895e-09 ] [ 1.319049405192521e-08 1.108443304410127e-09 -1.943331517324913e-08 ] [ 3.137404849540913e-09 4.065520932232731e-09 1.428825900937536e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.00069747064 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.117471153102413e-22 } "relaxed-configuration-positions" { "source-value" [ [ -1.2942683 3.1292037 0.9769604 ] [ 0.6722133 2.156138 1.6507128 ] [ 1.8298557 0.3837316 0.5627943 ] [ 3.8995416 1.4874977 0.9667939 ] [ 2.741903 3.2599054 2.0547105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.2942683e-10 3.1292037e-10 9.769604e-11 ] [ 6.722133000000001e-11 2.156138e-10 1.6507128e-10 ] [ 1.8298557e-10 3.837316e-11 5.627943e-11 ] [ 3.8995416e-10 1.4874977e-10 9.667939e-11 ] [ 2.741903000000001e-10 3.2599054e-10 2.0547105e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 -4.3e-06 4.3e-06 ] [ 2.12e-05 7.7e-06 -1.08e-05 ] [ -8.1e-06 -8.2e-06 -6e-07 ] [ -9.4e-06 6.3e-06 3.5e-06 ] [ -7.4e-06 -1.6e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 -6.889359469440001e-15 6.889359469440001e-15 ] [ 3.396614436096001e-14 1.233675998016e-14 -1.730350750464e-14 ] [ -1.297763062848e-14 -1.313784829056e-14 -9.6130597248e-16 ] [ -1.506046023552e-14 1.009371271104e-14 5.6076181728e-15 ] [ -1.185610699392e-14 -2.56348259328e-15 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.303472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811015857226742e-18 } }