{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5899248 -0.5933208 0.1576979 ] [ -3.0542002 0.8889523 -0.5403369 ] [ -1.4046804 0.7560037 -0.1198168 ] [ 1.3291903 0.1748385 -0.8140768 ] [ 1.5397654 -1.2264738 1.3165326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.547340343390116e-09 -9.506047143943526e-10 2.526598885292563e-10 ] [ -4.893368155682684e-09 1.424258592066388e-09 -8.657151485355476e-10 ] [ -2.250546096575992e-09 1.211251453378297e-09 -1.919676757390695e-10 ] [ 2.129597623254138e-09 2.801221571157409e-10 -1.304294816495677e-09 ] [ 2.46697612539676e-09 -1.965027648383735e-09 2.109317752241038e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.175578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.950742641632682e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4481904 2.4856935 1.3294996 ] [ 2.6092626 3.8320453 3.1306449 ] [ 5.4248623 2.010619 2.6052876 ] [ 4.7708833 4.2777876 2.2051528 ] [ 4.5859315 3.3569495 4.4064502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4481904e-10 2.4856935e-10 1.3294996e-10 ] [ 2.6092626e-10 3.8320453e-10 3.1306449e-10 ] [ 5.4248623e-10 2.010619e-10 2.6052876e-10 ] [ 4.770883300000001e-10 4.2777876e-10 2.2051528e-10 ] [ 4.5859315e-10 3.3569495e-10 4.4064502e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.49e-05 1.39e-05 -3.28e-05 ] [ -4.5e-06 -2.9e-06 2.13e-05 ] [ 2.35e-05 -9.5e-06 1.77e-05 ] [ 0.0 -1.46e-05 -5.3e-06 ] [ -4.2e-06 1.3e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.387243164992e-14 2.227025502912e-14 -5.255139316223999e-14 ] [ -7.2097947936e-15 -4.646312200320001e-15 3.412636202304e-14 ] [ 3.76511505888e-14 -1.52206778976e-14 2.835852618816e-14 ] [ 0.0 -2.339177866368e-14 -8.491536090240001e-15 ] [ -6.72914180736e-15 2.08282960704e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }