{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3768386 0.9256711 -1.0752163 ] [ 2.5111797 1.1377242 -1.0793399 ] [ -0.1967445 -2.0441717 -0.8921029 ] [ -0.6764997 -0.0452899 1.5433091 ] [ -0.0173229 0.7585059 0.3220049 ] [ -0.2522558 -1.6365752 2.5171337 ] [ -0.9915182 0.9041355 -1.3357885 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.037619997092724e-10 1.483088607189077e-09 -1.722686432355934e-09 ] [ 4.02335343911513e-09 1.822835129176343e-09 -1.729293167923896e-09 ] [ -3.152194407680129e-10 -3.275124133624058e-09 -1.429306421503638e-09 ] [ -1.08387201224801e-09 -7.256241953619659e-11 2.472653779059569e-09 ] [ -2.77543456131186e-11 1.21526042973114e-09 5.159087268135065e-10 ] [ -4.041583485509771e-10 -2.622082545223877e-09 4.032892798793965e-09 ] [ -1.588587292225739e-09 1.448584772069907e-09 -2.140169122665909e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.251839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.366225967932993e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4047563 2.3849068 1.8494616 ] [ 2.9489665 4.6978721 3.9908896 ] [ 1.1863181 3.226449 3.6622061 ] [ 4.6800539 2.6024702 1.3422351 ] [ 3.3566383 2.3505931 4.0001197 ] [ 3.3695366 4.5312638 1.6739743 ] [ 5.0128454 3.858435 3.2655968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4047563e-10 2.3849068e-10 1.8494616e-10 ] [ 2.9489665e-10 4.6978721e-10 3.9908896e-10 ] [ 1.1863181e-10 3.226449e-10 3.6622061e-10 ] [ 4.6800539e-10 2.6024702e-10 1.3422351e-10 ] [ 3.3566383e-10 2.3505931e-10 4.0001197e-10 ] [ 3.3695366e-10 4.5312638e-10 1.6739743e-10 ] [ 5.0128454e-10 3.858435e-10 3.2655968e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.44e-05 -6.43e-05 -5.57e-05 ] [ 1.44e-05 1.09e-05 8.09e-05 ] [ -3.29e-05 1.81e-05 -2.94e-05 ] [ 3.8e-05 -2.7e-05 -5.8e-05 ] [ -9.7e-06 4.56e-05 9.47e-05 ] [ -1.87e-05 4.43e-05 3.36e-05 ] [ -2.57e-05 -2.77e-05 -6.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.51148762096e-14 -1.030199575662e-13 -8.924123851379999e-14 ] [ 2.30713435296e-14 1.74637253106e-14 1.296160896906e-13 ] [ -5.271161125859999e-14 2.899939707539999e-14 -4.710399303959999e-14 ] [ 6.088271209199999e-14 -4.325876911799999e-14 -9.292624477199999e-14 ] [ -1.55411133498e-14 7.30592545104e-14 1.517261272398e-13 ] [ -2.99607030558e-14 7.09764248862e-14 5.383313490239999e-14 ] [ -4.11759394938e-14 -4.438029276179999e-14 -1.059038755074e-13 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431936313217e-18 } }