{ "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" [ [ 1.463501 2.539158 2.160753 ] [ 0.2382428 1.617471 2.877509 ] [ 1.691566 0.7573037 1.355751 ] [ 1.857 2.738979 0.0220673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.463501e-10 2.539158e-10 2.160753e-10 ] [ 2.382428e-11 1.617471e-10 2.877509e-10 ] [ 1.691566e-10 7.573037e-11 1.355751e-10 ] [ 1.857e-10 2.738979e-10 2.20673e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.4974407 11.2854605 -4.4157204 ] [ -12.8689911 -9.5643857 7.0917901 ] [ -0.3279043 -9.3307576 4.3133334 ] [ 0.6994548 7.6096828 -6.9894032 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.00231074743406e-08 1.808130111702995e-08 -7.074764047157133e-09 ] [ -2.061839684357396e-08 -1.532383528710374e-08 1.136230039145252e-08 ] [ -5.253606076481261e-10 -1.494952180423792e-08 6.910721988131775e-09 ] [ 1.120650137099143e-09 1.219205597431169e-08 -1.119825849264483e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.81041501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298427992864876e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7198962 2.555961 2.1506934 ] [ 0.0338063 1.7576153 2.7165491 ] [ 1.8804099 -0.0236404 1.6794519 ] [ 1.6161974 3.3629757 -0.1306141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7198962e-10 2.555961e-10 2.1506934e-10 ] [ 3.38063e-12 1.7576153e-10 2.7165491e-10 ] [ 1.8804099e-10 -2.36404e-12 1.6794519e-10 ] [ 1.6161974e-10 3.3629757e-10 -1.306141e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001887 -8.38e-05 -1.52e-05 ] [ 8.45e-05 3.6e-05 8.91e-05 ] [ 2.43e-05 -4e-07 -1.23e-05 ] [ 7.99e-05 4.81e-05 -6.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.023307308358e-13 -1.342624019292e-13 -2.43530848368e-14 ] [ 1.35383925573e-13 5.7678358824e-14 1.427539380894e-13 ] [ 3.893289220619999e-14 -6.408706536e-16 -1.97067725982e-14 ] [ 1.280139130566e-13 7.706469609539999e-14 -9.86940806544e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3191395 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.332873092188644e-18 } }