{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0873667 -1.6206939 1.0567618 ] [ -1.1258886 2.6072548 -2.5615751 ] [ 1.5516475 -1.2052752 0.3609474 ] [ -0.0681375 0.1303763 0.3040681 ] [ -0.4449881 0.088338 0.8397978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.399768841764474e-10 -2.596637876053173e-09 1.693119049714525e-09 ] [ -1.803872392545243e-09 4.17728268502858e-09 -4.104095737643423e-09 ] [ 2.486013348222768e-09 -1.931063747070044e-09 5.78301485618546e-10 ] [ -1.0916830949976e-10 2.08885859766407e-10 4.871708009510765e-10 ] [ -7.129495303542125e-10 1.415330783282304e-10 1.345504401359274e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.53731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.130222131532205e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9888578 2.1844604 1.7582921 ] [ 4.708195 1.3196303 3.1153817 ] [ 5.2906124 3.1469174 1.7487938 ] [ 3.3691606 4.5082994 1.7286471 ] [ 3.8365663 3.4105214 3.7589583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9888578e-10 2.1844604e-10 1.7582921e-10 ] [ 4.708195e-10 1.3196303e-10 3.1153817e-10 ] [ 5.2906124e-10 3.1469174e-10 1.7487938e-10 ] [ 3.3691606e-10 4.5082994e-10 1.7286471e-10 ] [ 3.8365663e-10 3.4105214e-10 3.758958300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.58e-05 -1.83e-05 -3e-06 ] [ 1.68e-05 -2.44e-05 1.88e-05 ] [ 1.17e-05 -3.6e-06 3.5e-06 ] [ -1.63e-05 5.48e-05 -1.37e-05 ] [ 3.6e-06 -8.4e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.531439060864e-14 -2.931983216064e-14 -4.8065298624e-15 ] [ 2.691656722944e-14 -3.909310954752e-14 3.012092047104e-14 ] [ 1.874546646336e-14 -5.76783583488e-15 5.6076181728e-15 ] [ -2.611547891904e-14 8.779927881984e-14 -2.194981970496e-14 ] [ 5.76783583488e-15 -1.345828361472e-14 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }