{ "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" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5925201 0.0173478 1.0315575 ] [ 0.7826624 -0.1043646 -1.0700155 ] [ -0.6306525 -2.4693616 -3.6067146 ] [ -0.9134236 1.7400353 0.7115064 ] [ 2.0142983 3.3625375 3.7738924 ] [ -0.6603645 -2.5461944 -0.8402262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.493218515740781e-10 2.779423958231424e-11 1.652737309510896e-09 ] [ 1.253963399259218e-09 -1.672105221591437e-10 -1.714353817993622e-09 ] [ -1.010416691349072e-09 -3.956353423821281e-09 -5.778593810018024e-09 ] [ -1.463465936806971e-09 2.787843877026714e-09 1.139958919629573e-09 ] [ 3.227261643577185e-09 5.38737896906328e-09 6.046442172694802e-09 ] [ -1.058020563106282e-09 -4.079453139691884e-09 -1.346190773823625e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.108763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.862649643500807e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2794405 1.3052711 3.3203031 ] [ 2.6131389 2.9642018 1.809801 ] [ 3.067957 0.6489094 1.9566777 ] [ 0.851941 3.7045801 3.2148547 ] [ 3.7181425 1.8197741 3.8790228 ] [ 3.191216 4.1981092 3.7507948 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2794405e-10 1.3052711e-10 3.3203031e-10 ] [ 2.6131389e-10 2.9642018e-10 1.809801e-10 ] [ 3.067957e-10 6.489094e-11 1.9566777e-10 ] [ 8.51941e-11 3.7045801e-10 3.2148547e-10 ] [ 3.7181425e-10 1.8197741e-10 3.8790228e-10 ] [ 3.191216e-10 4.1981092e-10 3.7507948e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.5e-06 -3.6e-06 6.5e-06 ] [ 3.9e-06 4e-06 8e-07 ] [ 2.9e-06 -5.1e-06 -4.2e-06 ] [ -1.2e-05 2.6e-06 -1.3e-06 ] [ -1.47e-05 1.48e-05 -3.2e-06 ] [ 1.34e-05 -1.27e-05 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.04141480352e-14 -5.76783583488e-15 1.04141480352e-14 ] [ 6.24848882112e-15 6.4087064832e-15 1.28174129664e-15 ] [ 4.646312200320001e-15 -8.17110076608e-15 -6.72914180736e-15 ] [ -1.92261194496e-14 4.16565921408e-15 -2.08282960704e-15 ] [ -2.355199632576e-14 2.371221398784e-14 -5.126965186560001e-15 ] [ 2.146916671872e-14 -2.034764308416e-14 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -25.785631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.131313514077573e-18 } }