{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -35.7972011 11.3361846 -34.294861 ] [ -7.2604185 -15.4032082 48.7365695 ] [ 18.7624744 -20.8341873 -21.3337697 ] [ -18.0381243 45.4151896 -30.183373 ] [ 42.3332695 -20.5139787 37.0754342 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.735343869249605e-08 1.8162569935193e-08 -5.494642450778571e-08 ] [ -1.163247277792381e-08 -2.467866006335485e-08 7.808459223089436e-08 ] [ 3.00607978320385e-08 -3.338004780542828e-08 -3.418046704687143e-08 ] [ -2.890026103654437e-08 7.276315500631931e-08 -4.835909455748596e-08 ] [ 6.78253746749257e-08 -3.286701707272917e-08 5.940139388124874e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.384665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.547724665224003e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1638384 0.9875761 0.8354932 ] [ 0.4069081 0.4372837 3.2032076 ] [ 1.9592065 -0.2627783 0.4305725 ] [ 1.4533135 2.8389831 1.2734099 ] [ 2.7101204 1.0214198 2.4359684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.638384e-11 9.875761e-11 8.354932000000001e-11 ] [ 4.069081e-11 4.372837e-11 3.2032076e-10 ] [ 1.9592065e-10 -2.627783e-11 4.305725000000001e-11 ] [ 1.4533135e-10 2.8389831e-10 1.2734099e-10 ] [ 2.7101204e-10 1.0214198e-10 2.4359684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.25e-05 9e-07 -4.4e-06 ] [ 6.1e-06 2.9e-06 8.4e-06 ] [ -1.04e-05 -4e-07 -7.3e-06 ] [ -1.21e-05 3.1e-06 -3.7e-06 ] [ -6.1e-06 -6.6e-06 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.604897396800001e-14 1.44195895872e-15 -7.04957713152e-15 ] [ 9.77327738688e-15 4.646312200320001e-15 1.345828361472e-14 ] [ -1.666263685632e-14 -6.408706483200001e-16 -1.169588933184e-14 ] [ -1.938633711168e-14 4.96674752448e-15 -5.928053496960001e-15 ] [ -9.77327738688e-15 -1.057436569728e-14 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }