{ "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" [ [ 0.4200245 0.9720887 1.368459 ] [ 0.2399871 2.852693 0.2124444 ] [ 1.085003 2.535414 2.951163 ] [ 2.377598 1.18625 1.814895 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.200245e-11 9.720887e-11 1.368459e-10 ] [ 2.399871e-11 2.852693e-10 2.124444e-11 ] [ 1.085003e-10 2.535414e-10 2.951163e-10 ] [ 2.377598e-10 1.18625e-10 1.814895e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7414197 -4.2642946 -2.6124187 ] [ -1.1581779 2.2258239 -2.9335444 ] [ -1.250162 4.1268626 5.4517384 ] [ 11.1497596 -2.0883919 0.0942247 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.400529839132729e-08 -6.832153168612376e-09 -4.185556199364656e-09 ] [ -1.855605569395188e-09 3.566163043978752e-09 -4.70005629248155e-09 ] [ -2.002980345114708e-09 6.611962829448488e-09 8.734647879160545e-09 ] [ 1.786388430583718e-08 -3.345972704814864e-09 1.509646126856598e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0886502 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.550739815039426e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3984184 1.4860167 1.2987725 ] [ -0.2428734 2.781921 -0.4837075 ] [ 1.227035 2.2948968 3.5147786 ] [ 2.7400326 0.9836112 2.0171178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.984184e-11 1.4860167e-10 1.2987725e-10 ] [ -2.428734e-11 2.781921e-10 -4.837075e-11 ] [ 1.227035e-10 2.2948968e-10 3.5147786e-10 ] [ 2.7400326e-10 9.836112000000001e-11 2.0171178e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.09e-05 4.1e-05 -4.61e-05 ] [ 2.7e-06 -3.12e-05 1.53e-05 ] [ 2.73e-05 -2.19e-05 8.6e-06 ] [ -9.1e-06 1.21e-05 2.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.34854916506e-14 6.568924199399999e-14 -7.386034282739999e-14 ] [ 4.3258769118e-15 -4.998791098079999e-14 2.45133025002e-14 ] [ 4.37394221082e-14 -3.50876682846e-14 1.37787190524e-14 ] [ -1.45798073694e-14 1.93863372714e-14 3.54081036114e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.474651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.197571117950473e-18 } }