{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0300197 -1.5382494 -0.0597379 ] [ 3.6449824 -0.1603635 6.4152394 ] [ -3.79999 5.8282167 -1.2654014 ] [ -5.4350393 -11.6206925 2.0017999 ] [ 9.0630348 1.7882677 5.4996385 ] [ -1.0126318 3.0747985 -6.664836 ] [ -3.4903758 2.6280225 -5.9267025 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.65027348230343e-09 -2.464547225639627e-09 -9.571066675568832e-11 ] [ 5.839905584507474e-09 -2.569306505296608e-10 1.027834658351502e-08 ] [ -6.088255137273792e-09 9.337832537696128e-09 -2.027396539007589e-09 ] [ -8.707892899589197e-09 -1.86184018410059e-08 3.207236999299778e-09 ] [ 1.452058247005681e-08 2.865120700671788e-09 8.811392227551581e-09 ] [ -1.622414995438622e-09 4.926370270370909e-09 -1.067824442066619e-08 ] [ -5.592198504566097e-09 4.210556208436368e-09 -9.495624183936912e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7587283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.082867646859933e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3025248 2.0487513 5.1140991 ] [ 2.5903919 4.4738565 1.9206422 ] [ 4.4150248 -0.7874889 0.5359662 ] [ 5.5294732 2.6088593 2.2131119 ] [ 4.6824834 1.3989843 0.5809437 ] [ 5.3557556 1.9786421 4.3229596 ] [ 2.1670303 3.4036711 3.7929504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3025248e-10 2.0487513e-10 5.1140991e-10 ] [ 2.5903919e-10 4.473856500000001e-10 1.9206422e-10 ] [ 4.415024800000001e-10 -7.874889e-11 5.359662e-11 ] [ 5.5294732e-10 2.6088593e-10 2.2131119e-10 ] [ 4.6824834e-10 1.3989843e-10 5.809437e-11 ] [ 5.3557556e-10 1.9786421e-10 4.3229596e-10 ] [ 2.1670303e-10 3.4036711e-10 3.7929504e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.5516053 0.3554277 0.0751973 ] [ -0.1588572 0.1735302 -0.1607742 ] [ -0.0881383 0.2856909 -0.277148 ] [ 0.2352417 -0.2565311 0.6295292 ] [ 0.0965633 -0.5139685 -0.1191854 ] [ 0.5200549 0.2701021 -0.5524696 ] [ -0.0532591 -0.3142513 0.4048508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.837691155693703e-10 5.694579513247162e-10 1.204793560072838e-10 ] [ -2.545172918857497e-10 2.780260294427481e-10 -2.575886644678234e-10 ] [ -1.412131236570566e-10 4.577272807553108e-10 -4.440400461014785e-10 ] [ 3.768987519772474e-10 -4.110081309281069e-10 1.008616966350927e-09 ] [ 1.547114616872967e-10 -8.234683145276449e-10 -1.909560614206963e-10 ] [ 8.332198023124819e-10 4.327512698489837e-10 -8.851538768227277e-10 ] [ -8.533048486484927e-11 -5.034860859160071e-10 6.486424866721767e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.278732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.447922720586883e-18 } }