{ "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" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.8586308 -4.4833132 -11.056596 ] [ -8.3359838 2.3280246 24.5857839 ] [ -34.610669 -118.1683928 -165.4864388 ] [ 71.0522768 93.5384844 128.5640597 ] [ 8.1047972 -10.113279 32.2735572 ] [ 1.6482095 36.8984759 -8.8803659 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.06562131632588e-08 -7.183059592764035e-09 -1.77146196168308e-08 ] [ -1.335571835572754e-08 3.729906586767272e-09 3.939076816862105e-08 ] [ -5.545240470204732e-08 -1.89326636261671e-07 -2.6513850330481e-07 ] [ 1.138382967435702e-07 1.498651728507455e-07 2.059823307264755e-07 ] [ 1.29853165901653e-08 -1.62032591734276e-08 5.170793881589151e-08 ] [ 2.640722727080458e-09 5.911787543013224e-08 -1.422791462912955e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 65.249947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.045419395918391e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.378277 0.484754 1.0017954 ] [ 0.4456759 -0.0918616 3.2579685 ] [ 2.0001264 -0.6675242 -0.2863248 ] [ 2.7002551 1.1263465 1.1429469 ] [ 2.6610113 0.5984979 3.4233553 ] [ 3.0084784 3.3965251 0.6973138 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.78277e-11 4.84754e-11 1.0017954e-10 ] [ 4.456759000000001e-11 -9.186160000000001e-12 3.2579685e-10 ] [ 2.0001264e-10 -6.675242e-11 -2.863248e-11 ] [ 2.7002551e-10 1.1263465e-10 1.1429469e-10 ] [ 2.6610113e-10 5.984979e-11 3.4233553e-10 ] [ 3.0084784e-10 3.3965251e-10 6.973138e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.53e-05 4e-06 -6.4e-06 ] [ 3.3e-06 -7.6e-06 8.7e-06 ] [ 1.7e-06 3e-07 8.7e-06 ] [ -3.34e-05 -4.46e-05 -1e-05 ] [ -1e-06 2.03e-05 -1.48e-05 ] [ 1.4e-05 2.76e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.451330229824e-14 6.4087064832e-15 -1.025393037312e-14 ] [ 5.28718284864e-15 -1.217654231808e-14 1.393893660096e-14 ] [ 2.72370025536e-15 4.8065298624e-16 1.393893660096e-14 ] [ -5.351269913472e-14 -7.145707728768e-14 -1.6021766208e-14 ] [ -1.6021766208e-15 3.252418540224e-14 -2.371221398784e-14 ] [ 2.24304726912e-14 4.422007473408001e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.980327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.560330631213901e-18 } }