{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9707291 1.323331 1.5068977 ] [ 1.6524936 -0.8399648 1.707587 ] [ -7.3936383 -1.1544432 3.6102464 ] [ -1.5565763 3.7036849 1.7885942 ] [ 6.326992 -3.032608 -8.6133253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.555279469150225e-09 2.120209989779885e-09 2.414316264877292e-09 ] [ 2.647586611941627e-09 -1.345771964854948e-09 2.73585596938201e-09 ] [ -1.184591442691146e-08 -1.849621905081538e-09 5.784252377407365e-09 ] [ -2.493910156351367e-09 5.933957357589985e-09 2.865643811338479e-09 ] [ 1.013695866238863e-08 -4.858773637651047e-09 -1.380006842300514e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8770276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.416036220516334e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6117392 -0.6500766 4.1600741 ] [ 4.0691666 3.1278702 -0.3683259 ] [ 1.8464475 1.1266525 4.5615481 ] [ 3.1272848 2.7067596 3.7214714 ] [ 3.9462209 3.4247522 1.8079943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.117392000000001e-11 -6.500766e-11 4.1600741e-10 ] [ 4.0691666e-10 3.1278702e-10 -3.683259e-11 ] [ 1.8464475e-10 1.1266525e-10 4.5615481e-10 ] [ 3.1272848e-10 2.7067596e-10 3.7214714e-10 ] [ 3.9462209e-10 3.4247522e-10 1.8079943e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0261476 -0.0165496 0.0921961 ] [ 0.0631263 0.0635772 -0.1090693 ] [ -0.0595368 -0.0787569 0.011568 ] [ 0.0635152 0.0602589 -0.1267971 ] [ -0.040957 -0.0285296 0.1321023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.189307341003008e-11 -2.651538220359168e-11 1.477144359489389e-10 ] [ 1.01139482017607e-10 1.018619034559258e-10 -1.747482825070214e-10 ] [ -9.538846903724543e-11 -1.261824639066835e-10 1.85339791494144e-11 ] [ 1.017625685054362e-10 9.654540077512511e-11 -2.031513492052397e-10 ] [ -6.56203478581056e-11 -4.570945812077567e-11 2.116512166139079e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.062842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.772462681200431e-18 } }