{ "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" [ [ 0.9398812 2.717033 1.670565 ] [ 2.278193 2.647912 4.038221 ] [ 1.856764 5.001969 2.684043 ] [ 3.35912 1.891848 2.112837 ] [ 5.060666 2.631323 3.812603 ] [ 4.070835 4.158298 1.920429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.398812e-11 2.717033e-10 1.670565e-10 ] [ 2.278193e-10 2.647912e-10 4.038221e-10 ] [ 1.856764e-10 5.001969e-10 2.684043e-10 ] [ 3.35912e-10 1.891848e-10 2.112837e-10 ] [ 5.060666e-10 2.631323e-10 3.812603e-10 ] [ 4.070835e-10 4.158298e-10 1.920429e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 6.1985828 -4.4436832 -11.0831512 ] [ 1.193959 -0.4545063 -0.4117767 ] [ -2.9220026 15.04059 10.2611425 ] [ 0.0 0.0 0.0 ] [ -4.4705392 -10.1424006 1.2337854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 9.931224444253002e-09 -7.11956533328173e-09 -1.775716573743147e-08 ] [ 1.912933195993747e-09 -7.281993678663111e-10 -6.597390017301755e-10 ] [ -4.681564251636814e-09 2.409768166103827e-08 1.644016261619726e-08 ] [ 0.0 0.0 0.0 ] [ -7.162593388609935e-09 -1.624991712010789e-08 1.976742122964376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.35235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.76888017393888e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2368382 1.4411013 2.4879484 ] [ 1.9147992 1.6243068 2.9179054 ] [ 2.6880916 6.6084903 1.6016948 ] [ 3.8088794 2.7430575 3.0717266 ] [ 5.6686311 1.805321 3.7966297 ] [ 3.721896 4.8261061 2.3627931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.368382e-11 1.4411013e-10 2.4879484e-10 ] [ 1.9147992e-10 1.6243068e-10 2.9179054e-10 ] [ 2.6880916e-10 6.6084903e-10 1.6016948e-10 ] [ 3.8088794e-10 2.7430575e-10 3.0717266e-10 ] [ 5.6686311e-10 1.805321e-10 3.7966297e-10 ] [ 3.721896e-10 4.8261061e-10 2.3627931e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2083044 -0.0316007 0.0532018 ] [ -0.3653849 -0.0884211 -0.0340859 ] [ -0.017053 0.1278198 -0.0453881 ] [ 0.2467277 -0.4833527 0.1568603 ] [ -0.1035175 0.0628956 -0.0250908 ] [ 0.0309232 0.4126591 -0.1054974 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.337404396897715e-10 -5.062990274091457e-11 8.523868014447744e-11 ] [ -5.854111443733459e-10 -1.416662192054189e-10 -5.461163207892672e-11 ] [ -2.73219179145024e-11 2.047898952353319e-10 -7.271975268253249e-11 ] [ 3.953013526437561e-10 -7.744163955405562e-10 2.513179053916742e-10 ] [ -1.65853318343664e-10 1.007698598711885e-10 -4.019989315716864e-11 ] [ 4.954442808032256e-11 6.611527623803693e-10 -1.690254678351859e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.004527 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.083554912396236e-18 } }