{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7262664 -2.3727669 1.505567 ] [ 4.1132515 -14.8905063 -6.7403436 ] [ 2.6455792 -1.9248185 5.0153383 ] [ -0.8065233 -1.5380045 0.9437682 ] [ 10.43369 4.9882756 0.2499457 ] [ -3.5781316 3.7424937 -11.2661526 ] [ -5.0815993 11.9953269 10.2918772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.237884339215258e-08 -3.801591653788091e-09 2.412184248447994e-09 ] [ 6.590155388770531e-09 -2.385722106573511e-08 -1.079922093207891e-08 ] [ 4.238685142714767e-09 -3.083899199983325e-09 8.035457769662816e-09 ] [ -1.292192775390465e-09 -2.464154852585194e-09 1.512083345494499e-09 ] [ 1.671661418667476e-08 7.992098544427093e-09 4.004571570094906e-10 ] [ -5.732798795665697e-09 5.996135909631289e-09 -1.805036630208514e-08 ] [ -8.141619594733646e-09 1.921863231803334e-08 1.648940503398457e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.69341133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.110967421523834e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2829 2.9249986 2.6760024 ] [ 4.3334053 0.6872163 1.1913707 ] [ 5.2259486 2.4514875 4.3036204 ] [ 3.5638911 0.9717376 3.4376777 ] [ 5.4728181 4.0210993 2.2787455 ] [ 3.8837836 3.0054908 0.8140026 ] [ 3.5091893 4.4762724 4.0279487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2829e-10 2.9249986e-10 2.6760024e-10 ] [ 4.3334053e-10 6.872163000000001e-11 1.1913707e-10 ] [ 5.2259486e-10 2.4514875e-10 4.3036204e-10 ] [ 3.5638911e-10 9.717376e-11 3.4376777e-10 ] [ 5.4728181e-10 4.021099300000001e-10 2.2787455e-10 ] [ 3.8837836e-10 3.0054908e-10 8.140026e-11 ] [ 3.5091893e-10 4.4762724e-10 4.0279487e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.98e-05 -6.8e-06 -8.9e-06 ] [ -4.3e-05 -3.54e-05 4.8e-06 ] [ -8.3e-06 2.45e-05 -8e-07 ] [ 2.11e-05 9.8e-06 -3.63e-05 ] [ -3.8e-06 1.96e-05 2.57e-05 ] [ 1.7e-06 -4.2e-06 1.56e-05 ] [ 2.4e-06 -7.5e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.774486329984001e-14 -1.089480102144e-14 -1.425937192512e-14 ] [ -6.889359469439999e-14 -5.671705237632e-14 7.69044777984e-15 ] [ -1.329806595264e-14 3.92533272096e-14 -1.28174129664e-15 ] [ 3.380592669888e-14 1.570133088384e-14 -5.815901133504e-14 ] [ -6.08827115904e-15 3.140266176767999e-14 4.117593915456e-14 ] [ 2.72370025536e-15 -6.72914180736e-15 2.499395528448e-14 ] [ 3.84522388992e-15 -1.2016324656e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.819793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.89373960072955e-18 } }