{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.756867 -3.7773477 -0.6172772 ] [ 2.5330277 1.4512057 0.8055971 ] [ 2.3600683 -0.727603 -0.1307737 ] [ -2.9024481 -2.605433 -1.0273965 ] [ -1.0062331 7.7620372 2.6726757 ] [ 0.4270382 3.4172712 1.0358558 ] [ 1.345414 -5.5201305 -2.7386812 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.416987854055034e-09 -6.051978173572652e-09 -9.889870983928857e-10 ] [ 4.058357760778796e-09 2.325087844511699e-09 1.29070883940428e-09 ] [ 3.7812462537512e-09 -1.165748515823942e-09 -2.09522564755513e-10 ] [ -4.650234488905381e-09 -4.174363839660807e-09 -1.646070652591747e-09 ] [ -1.612163147895109e-09 1.243615453161989e-08 4.282098521520275e-09 ] [ 6.841906202285145e-10 5.475072023573162e-09 1.659623945280081e-09 ] [ 2.155590856097011e-09 -8.844224030865014e-09 -4.387850990464489e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4674691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.516855765016642e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5827025 3.7947972 2.3921633 ] [ 2.4590381 3.9526549 4.4083421 ] [ 6.8648709 3.2656267 0.8685342 ] [ 2.6530222 3.1694043 0.5740009 ] [ 6.3927089 2.4820194 4.4042759 ] [ 4.8051629 2.9504006 0.1592105 ] [ 4.4928676 3.3945069 5.0379451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5827025e-10 3.7947972e-10 2.3921633e-10 ] [ 2.4590381e-10 3.9526549e-10 4.4083421e-10 ] [ 6.8648709e-10 3.2656267e-10 8.685342000000001e-11 ] [ 2.6530222e-10 3.1694043e-10 5.740009e-11 ] [ 6.3927089e-10 2.4820194e-10 4.4042759e-10 ] [ 4.8051629e-10 2.9504006e-10 1.592105e-11 ] [ 4.4928676e-10 3.3945069e-10 5.0379451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1020258 0.0659367 0.4131371 ] [ -0.2135656 -0.0080547 -0.2725751 ] [ -0.0420442 -0.0495147 -0.1052896 ] [ 0.2449964 -0.0172046 -0.2424059 ] [ 0.0211634 0.0265431 0.107613 ] [ -0.0547133 0.0194937 -0.042248 ] [ 0.1461891 -0.0371994 0.1417685 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.634633514784167e-10 1.056422391927034e-10 6.619186028051116e-10 ] [ -3.421698113271245e-10 -1.290505202755776e-11 -4.367134526322221e-10 ] [ -6.736223428023935e-11 -7.933129472592577e-11 -1.686925355333837e-10 ] [ 3.925275042601651e-10 -2.756480789021568e-11 -3.883770657239828e-10 ] [ 3.390750469663872e-11 4.252673426355648e-11 1.724150326941504e-10 ] [ -8.766037010681664e-11 3.123235039288896e-11 -6.76887578755584e-11 ] [ 2.342207582357933e-10 -5.960000898778752e-11 2.271381762658848e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.137474 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.585508356156786e-18 } }