{ "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" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9591476 -0.3455034 0.5448349 ] [ 0.7528241 0.4608689 -0.486308 ] [ -0.0811452 -2.1934875 -2.3026937 ] [ 0.0853818 0.7449348 0.5815095 ] [ 1.6618763 2.7390734 2.2914875 ] [ -0.4597895 -1.4058863 -0.6288302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.13890048141643e-09 -5.535574698869108e-10 8.72921738975906e-10 ] [ 1.206157172594801e-09 7.383933768338131e-10 -7.791513081080065e-10 ] [ -1.300089423301402e-10 -3.51435439051704e-09 -3.689322011003449e-09 ] [ 1.367967238018214e-10 1.193517120580324e-09 9.316809256730977e-10 ] [ 2.662619354521607e-09 4.388479364135167e-09 3.67136769935544e-09 ] [ -7.366639873893217e-10 -2.252478161363015e-09 -1.007497044892988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.825341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.69571679871877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7487659 1.2137199 3.0765325 ] [ 2.6839898 3.0774015 1.6800223 ] [ 2.9018655 0.867703 2.3698236 ] [ 0.9159541 3.4930333 3.2000707 ] [ 4.3152993 2.0028739 3.7871607 ] [ 3.1559613 3.9861141 3.8178442 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.487659e-11 1.2137199e-10 3.0765325e-10 ] [ 2.6839898e-10 3.0774015e-10 1.6800223e-10 ] [ 2.9018655e-10 8.67703e-11 2.3698236e-10 ] [ 9.159541e-11 3.4930333e-10 3.2000707e-10 ] [ 4.315299300000001e-10 2.0028739e-10 3.7871607e-10 ] [ 3.1559613e-10 3.9861141e-10 3.8178442e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.22e-05 2.03e-05 -1.48e-05 ] [ -7.4e-06 -3.04e-05 -8.4e-06 ] [ 3.59e-05 1.42e-05 3.59e-05 ] [ -3.43e-05 2.76e-05 6.7e-06 ] [ -2.68e-05 2.8e-06 -3.98e-05 ] [ 1.03e-05 -3.45e-05 2.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.556832098176e-14 3.252418540224e-14 -2.371221398784e-14 ] [ -1.185610699392e-14 -4.870616927232e-14 -1.345828361472e-14 ] [ 5.751814068672e-14 2.275090801536e-14 5.751814068672e-14 ] [ -5.495465809344e-14 4.422007473408001e-14 1.073458335936e-14 ] [ -4.293833343744e-14 4.48609453824e-15 -6.376662950784e-14 ] [ 1.650241919424e-14 -5.52750934176e-14 3.268440306432e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.48669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961894251397715e-18 } }