{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.0684404 -18.208949 -5.1940391 ] [ -17.3684031 3.2177835 -8.2963722 ] [ -9.1717131 -6.5046077 14.0841297 ] [ -2.7814361 17.1606769 3.022722 ] [ 16.7268319 -1.3051435 -1.5969639 ] [ 3.1094902 4.9089725 -14.691504 ] [ 5.4167898 0.7312673 12.6720274 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.518360091998201e-09 -2.917395237713954e-08 -8.321768013541075e-09 ] [ -2.782724938745024e-08 5.155457494495997e-09 -1.329225357629506e-08 ] [ -1.469470430150509e-08 -1.042153038441566e-08 2.256526332965492e-08 ] [ -4.456351891669131e-09 2.749443532628262e-08 4.842934519577818e-09 ] [ 2.679933901023165e-08 -2.091070402489085e-09 -2.558618224841589e-09 ] [ 4.981952501046717e-09 7.865040971650128e-09 -2.353838423318968e-08 ] [ 8.678653977347907e-09 1.17161937161554e-09 2.030282603841701e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 77.68741 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.244689520325041e-17 } "relaxed-configuration-positions" { "source-value" [ [ 3.2462299 -0.6423031 1.3908818 ] [ -0.8959261 3.231416 0.8100387 ] [ 0.454421 1.3221998 5.7881364 ] [ 2.6750365 6.6936169 3.3766304 ] [ 7.2133431 3.1060714 2.3413075 ] [ 3.8118383 4.4003965 -1.7823423 ] [ 5.1507803 3.6828975 7.4071842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2462299e-10 -6.423031e-11 1.3908818e-10 ] [ -8.959260999999999e-11 3.231416e-10 8.100387e-11 ] [ 4.54421e-11 1.3221998e-10 5.7881364e-10 ] [ 2.6750365e-10 6.6936169e-10 3.3766304e-10 ] [ 7.213343100000001e-10 3.1060714e-10 2.3413075e-10 ] [ 3.8118383e-10 4.400396500000001e-10 -1.7823423e-10 ] [ 5.150780300000001e-10 3.682897500000001e-10 7.4071842e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }