{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3388201 -2.3377372 -7.9846476 ] [ -12.5002861 -5.9680972 4.5375782 ] [ 10.5433425 -6.2492859 -5.2288623 ] [ 2.3396479 1.0978717 10.6337641 ] [ 1.9561157 13.4572486 -1.9578324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.747202884477118e-09 -3.745467887414454e-09 -1.279281571004683e-08 ] [ -2.002766614273121e-08 -9.561945804501941e-09 7.270001707091747e-09 ] [ 1.689229685858702e-08 -1.001245976567509e-08 -8.377560930442518e-09 ] [ 3.748529166283816e-09 1.758984370377951e-09 1.703716823212235e-08 ] [ 3.134042842119827e-09 2.156088908721353e-08 -3.136793298724754e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.4822181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.579128428346597e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2552181 1.2348695 1.3966802 ] [ 1.2048926 1.5793905 3.4854957 ] [ 4.1699328 2.6170904 1.3052411 ] [ 2.4704705 3.1745373 4.6850155 ] [ 4.302966 3.8158713 3.337544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2552181e-10 1.2348695e-10 1.3966802e-10 ] [ 1.2048926e-10 1.5793905e-10 3.4854957e-10 ] [ 4.1699328e-10 2.6170904e-10 1.3052411e-10 ] [ 2.4704705e-10 3.1745373e-10 4.685015500000001e-10 ] [ 4.302966e-10 3.8158713e-10 3.337544e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 1e-07 1e-07 0.0 ] [ -0.0 0.0 1e-07 ] [ -1e-07 -1e-07 0.0 ] [ 0.0 -1e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 1.6021766208e-16 0.0 ] [ 0.0 0.0 1.6021766208e-16 ] [ -1.6021766208e-16 -1.6021766208e-16 0.0 ] [ 0.0 -1.6021766208e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }