{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2878456 -3.6312682 1.3956744 ] [ -2.8431984 3.0253159 -0.0181871 ] [ 1.1996745 -0.7431667 0.0686116 ] [ -0.2213576 1.5345086 -0.760366 ] [ 3.3317469 -0.517645 0.8526365 ] [ -1.7547111 0.3322554 -1.5383693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.611794945197103e-10 -5.817933061827238e-09 2.236116912351969e-09 ] [ -4.555306042306186e-09 4.84709044544868e-09 -2.91389466602214e-11 ] [ 1.922090452305633e-09 -1.190684321906888e-09 1.099279023413544e-10 ] [ -3.546539744783184e-10 2.458553823592052e-09 -1.218240638488044e-09 ] [ 5.338047033581934e-09 -8.2935872370693e-10 1.366074277595541e-09 ] [ -2.811357123840437e-09 5.323318384003235e-10 -2.464739346922936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.03668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409141734893512e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6563499 0.7084672 0.5051895 ] [ 0.025147 2.9815865 0.8204962 ] [ 0.4627081 2.7881775 3.0907528 ] [ 1.0939099 0.5150606 2.7754464 ] [ 2.2897881 2.4314164 0.3371482 ] [ 2.7273464 2.2380091 2.6074052 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.563499000000001e-11 7.084672e-11 5.051895e-11 ] [ 2.5147e-12 2.9815865e-10 8.204962e-11 ] [ 4.627081e-11 2.7881775e-10 3.0907528e-10 ] [ 1.0939099e-10 5.150606e-11 2.7754464e-10 ] [ 2.2897881e-10 2.4314164e-10 3.371482e-11 ] [ 2.7273464e-10 2.2380091e-10 2.6074052e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.3e-06 1.38e-05 -9.1e-06 ] [ 9.6e-06 -7.9e-06 -1.07e-05 ] [ -6.8e-06 9.8e-06 1.05e-05 ] [ 4e-06 -7.9e-06 5.7e-06 ] [ -1.99e-05 -5.6e-06 -3.8e-06 ] [ 8.8e-06 -2.2e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.8893595262e-15 2.21100375492e-14 -1.45798073694e-14 ] [ 1.53808956864e-14 -1.26571954086e-14 -1.71432899838e-14 ] [ -1.08948011112e-14 1.57013310132e-14 1.6822854657e-14 ] [ 6.408706535999999e-15 -1.26571954086e-14 9.1324068138e-15 ] [ -3.18833150166e-14 -8.972189150399999e-15 -6.088271209199999e-15 ] [ 1.40991543792e-14 -3.5247885948e-15 1.18561070916e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }