{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9925273 0.3379082 1.803379 ] [ 1.204741 2.296652 0.0005587 ] [ 2.970089 0.0748089 0.2894365 ] [ 2.914059 2.502311 2.040612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.925273e-11 3.379082e-11 1.803379e-10 ] [ 1.204741e-10 2.296652e-10 5.587e-14 ] [ 2.970089000000001e-10 7.48089e-12 2.894365e-11 ] [ 2.914059e-10 2.502311e-10 2.040612e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.355896 1.1010799 -1.3230989 ] [ 1.1255677 -1.2062107 1.7096552 ] [ -1.3053415 1.0082679 0.856125 ] [ -1.1761222 -0.9031371 -1.2426814 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.172384871436237e-09 1.764124473412802e-09 -2.119838124586197e-09 ] [ 1.803358254067628e-09 -1.932562583298803e-09 2.739169591069148e-09 ] [ -2.091387633460003e-09 1.615423256883113e-09 1.3716634594824e-09 ] [ -1.884355492043862e-09 -1.446985146997112e-09 -1.990995086183013e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.5676596203271203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.113844213860317e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0614297 0.5441961 1.8294872 ] [ 1.3057855 2.1080666 0.0486466 ] [ 2.9202189 0.3815436 0.3478509 ] [ 2.7939822 2.1778739 1.9080015 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0614297e-10 5.441961e-11 1.8294872e-10 ] [ 1.3057855e-10 2.1080666e-10 4.86466e-12 ] [ 2.9202189e-10 3.815436e-11 3.478509000000001e-11 ] [ 2.7939822e-10 2.1778739e-10 1.9080015e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -3.7e-06 1.04e-05 ] [ -4e-07 8.7e-06 -7.4e-06 ] [ 4.9e-06 2.6e-06 1.9e-06 ] [ -3e-06 -7.6e-06 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -5.928053496960001e-15 1.666263685632e-14 ] [ -6.408706483200001e-16 1.393893660096e-14 -1.185610699392e-14 ] [ 7.850665441919999e-15 4.16565921408e-15 3.04413557952e-15 ] [ -4.8065298624e-15 -1.217654231808e-14 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -4.0298336203271194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.456505212201934e-19 } }