{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.601927 2.20995 2.424099 ] [ 1.129906 4.274554 2.615066 ] [ 2.801527 4.173724 0.979437 ] [ 2.35061 3.246819 4.113867 ] [ 5.119967 2.708037 1.074647 ] [ 4.165482 2.492594 3.422722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.601927e-10 2.20995e-10 2.424099e-10 ] [ 1.129906e-10 4.274554e-10 2.615066e-10 ] [ 2.801527e-10 4.173724e-10 9.79437e-11 ] [ 2.35061e-10 3.246819e-10 4.113867e-10 ] [ 5.119967e-10 2.708037e-10 1.074647e-10 ] [ 4.165482e-10 2.492594e-10 3.422722e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5168805 -7.4106195 -4.8882423 ] [ -5.1543175 7.8274908 -1.5383977 ] [ 4.9011954 -3.096395 -1.0650103 ] [ 2.1880281 1.3683484 8.3135541 ] [ -5.3475899 2.5461655 2.2784285 ] [ 2.8958033 -1.2349901 -3.1003324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.281338528474144e-10 -1.187312130854459e-08 -7.83182752986562e-09 ] [ -8.258126994680305e-09 1.254102275928709e-08 -2.464784828432492e-09 ] [ 7.852580683852504e-09 -4.960971677762016e-09 -1.706334603571194e-09 ] [ 3.505607467473445e-09 2.192335815589087e-09 1.331978201477598e-08 ] [ -8.56778351540621e-09 4.079406836787542e-09 3.650444874864413e-09 ] [ 4.639588345695489e-09 -1.978672265139454e-09 -4.967280087988754e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.644995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.02595153591329e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.738453 2.0228729 2.3089201 ] [ 1.2871599 4.591048 2.5816641 ] [ 2.7525124 3.7517177 0.7493619 ] [ 2.3315362 3.3698292 4.4786125 ] [ 4.9518386 3.2035151 1.2999353 ] [ 4.1079189 2.1666951 3.2113439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.738453e-10 2.0228729e-10 2.3089201e-10 ] [ 1.2871599e-10 4.591048e-10 2.5816641e-10 ] [ 2.7525124e-10 3.7517177e-10 7.493619e-11 ] [ 2.3315362e-10 3.3698292e-10 4.4786125e-10 ] [ 4.951838600000001e-10 3.2035151e-10 1.2999353e-10 ] [ 4.1079189e-10 2.1666951e-10 3.2113439e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.64e-05 4.05e-05 -1.96e-05 ] [ 2.87e-05 -9.5e-06 -8.3e-06 ] [ -2.36e-05 -1.97e-05 -2.1e-06 ] [ -2.49e-05 -1.31e-05 3.08e-05 ] [ -2.24e-05 -8.4e-06 7e-07 ] [ 5.9e-06 1.01e-05 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.831922899712e-14 6.488815314240001e-14 -3.140266176767999e-14 ] [ 4.598246901696e-14 -1.52206778976e-14 -1.329806595264e-14 ] [ -3.781136825088e-14 -3.156287942976e-14 -3.36457090368e-15 ] [ -3.989419785791999e-14 -2.098851373248e-14 4.934703992064001e-14 ] [ -3.588875630592e-14 -1.345828361472e-14 1.12152363456e-15 ] [ 9.45284206272e-15 1.618198387008e-14 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.047769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.0517890170199e-18 } }