{ "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" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8992572 0.9190775 -2.2412801 ] [ -12.4838406 2.7198807 11.2647844 ] [ 36.0539667 -53.6455921 -12.8251911 ] [ 0.6918996 -11.5536169 0.7671617 ] [ -33.2287243 41.8089682 -40.8720003 ] [ 15.8659558 19.7512825 43.9065255 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105382867779626e-08 1.472524495335135e-09 -3.590926606469183e-09 ] [ -2.000131771190054e-08 4.357729304807564e-09 1.804817435272771e-08 ] [ 5.776482300975408e-08 -8.594971417971499e-08 -2.054822150700476e-08 ] [ 1.108545372193946e-09 -1.851093503536751e-08 1.229128550239718e-09 ] [ -5.323828565108801e-08 6.698535194168903e-08 -6.5484163865501e-08 ] [ 2.542006365883677e-08 3.16450433130331e-08 7.034600923622517e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.81571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.694173764612014e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1895194 2.665717 0.6145761 ] [ 0.5983635 1.6743688 2.6381464 ] [ 3.3833192 1.0642257 0.7981009 ] [ 1.802084 -0.2784724 1.9779742 ] [ 2.05475 3.0282572 -0.1114064 ] [ 2.6874743 2.9572653 2.3567396 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.895194e-11 2.665717e-10 6.145761e-11 ] [ 5.983635000000001e-11 1.6743688e-10 2.6381464e-10 ] [ 3.3833192e-10 1.0642257e-10 7.981009000000001e-11 ] [ 1.802084e-10 -2.784724e-11 1.9779742e-10 ] [ 2.05475e-10 3.0282572e-10 -1.114064e-11 ] [ 2.6874743e-10 2.9572653e-10 2.3567396e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.1e-06 -1.12e-05 1.3e-06 ] [ 4e-06 2.34e-05 -9e-07 ] [ -1.04e-05 6.8e-06 3.25e-05 ] [ 1.34e-05 1.33e-05 -1.86e-05 ] [ -1.5e-06 4.1e-06 8.4e-06 ] [ 3.6e-06 -3.65e-05 -2.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.45798073694e-14 -1.79443783008e-14 2.0828296242e-15 ] [ 6.408706535999999e-15 3.749093323559999e-14 -1.4419589706e-15 ] [ -1.66626369936e-14 1.08948011112e-14 5.207074060499999e-14 ] [ 2.14691668956e-14 2.13089492322e-14 -2.98004853924e-14 ] [ -2.403264951e-15 6.568924199399999e-15 1.34582837256e-14 ] [ 5.767835882399999e-15 -5.847944714099999e-14 -3.636940959179999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.527678 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.327590623787585e-18 } }