{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3662475 -2.3117074 -4.5108876 ] [ -0.5612277 -27.1354487 13.3634784 ] [ -29.2917489 6.2609723 -12.3515428 ] [ -3.9356676 -5.8275783 -23.8862578 ] [ 5.7914423 5.4190741 23.7995399 ] [ 13.0223112 5.5957128 -19.9465152 ] [ 15.3411382 17.9989752 23.5321851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.86793181926448e-10 -3.703763550410354e-09 -7.227238651776623e-09 ] [ -8.991858998853562e-10 -4.347578150205776e-08 2.141065266504579e-08 ] [ -4.693055526992412e-08 1.00311834425364e-08 -1.978935310497057e-08 ] [ -6.305634615960047e-09 -9.33680970814141e-09 -3.827000380556164e-08 ] [ 9.27891345377218e-09 8.6823138294028e-09 3.813106641357677e-08 ] [ 2.0864042553422e-08 8.965320224871307e-09 -3.195784031987184e-08 ] [ 2.457921296050179e-08 2.8837537263799e-08 3.770271680355811e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8742245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.20719191763057e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7434724 1.9917453 1.5757836 ] [ 2.8027217 2.5192943 4.0540118 ] [ 1.9015122 4.2739073 2.2872929 ] [ 5.0402188 2.8287498 1.2354806 ] [ 5.2892529 2.8490366 3.6908819 ] [ 4.1256673 5.1144946 1.4097983 ] [ 3.8732396 4.9378922 3.9254509 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7434724e-10 1.9917453e-10 1.5757836e-10 ] [ 2.802721700000001e-10 2.5192943e-10 4.0540118e-10 ] [ 1.9015122e-10 4.273907300000001e-10 2.2872929e-10 ] [ 5.0402188e-10 2.8287498e-10 1.2354806e-10 ] [ 5.289252900000001e-10 2.8490366e-10 3.6908819e-10 ] [ 4.1256673e-10 5.1144946e-10 1.4097983e-10 ] [ 3.8732396e-10 4.9378922e-10 3.9254509e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.32e-05 -1.23e-05 1.33e-05 ] [ 1.14e-05 1.42e-05 -9.2e-06 ] [ 2.02e-05 5.03e-05 4.5e-06 ] [ 3.71e-05 -2.82e-05 -3.64e-05 ] [ -3.99e-05 1.91e-05 -8.8e-06 ] [ -4.45e-05 -2.33e-05 1.67e-05 ] [ -7.6e-06 -1.98e-05 1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.717049760256e-14 -1.970677243584e-14 2.130894905664e-14 ] [ 1.826481347712e-14 2.275090801536e-14 -1.474002491136e-14 ] [ 3.236396774016e-14 8.058948402624e-14 7.2097947936e-15 ] [ 5.944075263168e-14 -4.518138070656001e-14 -5.831922899712e-14 ] [ -6.392684716992e-14 3.060157345728e-14 -1.409915426304e-14 ] [ -7.129685962560001e-14 -3.733071526464e-14 2.675634956736e-14 ] [ -1.217654231808e-14 -3.172309709184e-14 3.188331475392e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }