{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.6596843 -24.4398324 -81.7006012 ] [ -8.8675539 3.823814 42.1927704 ] [ -59.3750389 37.6941906 108.0564543 ] [ 45.0808008 -41.6945793 20.391369 ] [ 45.8214762 24.6164072 -88.9399925 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.630481642016881e-08 -3.915692808755036e-08 -1.308987931479444e-07 ] [ -1.420738754226386e-08 6.126425393087731e-09 6.760027030166227e-08 ] [ -9.512929918467055e-08 6.039275091929912e-08 1.731255248060036e-07 ] [ 7.222740508870194e-08 -6.680208016855163e-08 3.267057467790588e-08 ] [ 7.341409789818362e-08 3.943983210393279e-08 -1.424975766376274e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 43.042294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.896135715240012e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5021803 -0.1032684 0.6468238 ] [ -0.0336443 0.8154945 3.0182564 ] [ 1.2921593 3.0015753 3.3485358 ] [ 2.4822049 0.9764961 1.9142726 ] [ 2.6586892 3.4520926 1.1841529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.021803e-11 -1.032684e-11 6.468238e-11 ] [ -3.36443e-12 8.154945e-11 3.0182564e-10 ] [ 1.2921593e-10 3.0015753e-10 3.3485358e-10 ] [ 2.4822049e-10 9.764961e-11 1.9142726e-10 ] [ 2.6586892e-10 3.4520926e-10 1.1841529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.7e-06 -1.98e-05 1.54e-05 ] [ -5.6e-06 1.69e-05 -2.52e-05 ] [ 1.19e-05 -1.01e-05 9.6e-06 ] [ 6.5e-06 7.4e-06 -7.1e-06 ] [ -8.2e-06 5.6e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.53023011776e-15 -3.172309709184e-14 2.467351996032e-14 ] [ -8.972189076479999e-15 2.707678489152e-14 -4.037485084416e-14 ] [ 1.906590178752e-14 -1.618198387008e-14 1.538089555968e-14 ] [ 1.04141480352e-14 1.185610699392e-14 -1.137545400768e-14 ] [ -1.313784829056e-14 8.972189076479999e-15 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.638041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.505490368531185e-18 } }