{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8534604 -6.6050743 -10.9788022 ] [ -6.5670091 -2.8235808 5.4231507 ] [ -5.3884873 11.7035493 12.6584054 ] [ 13.4628224 -11.6622983 2.2475647 ] [ 5.3461344 9.3874041 -9.3503186 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.098045402445862e-08 -1.058249562210693e-08 -1.758998020922761e-08 ] [ -1.052150844860085e-08 -4.52387514469976e-09 8.688845262615155e-09 ] [ -8.633308373537717e-09 1.875115306884021e-08 2.028100118848847e-08 ] [ 2.156981929926255e-08 -1.868506168105559e-08 3.600995616075366e-09 ] [ 8.565451547334636e-09 1.504027937902207e-08 -1.498086185795139e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.5230655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.042396556847063e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8557059 -0.1011953 1.413661 ] [ -0.2495672 1.164883 2.8977153 ] [ 0.8977066 3.0715536 3.1722563 ] [ 2.6858099 1.0232005 0.7706528 ] [ 2.7119343 2.9839484 1.857756 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.557059e-11 -1.011953e-11 1.413661e-10 ] [ -2.495672e-11 1.164883e-10 2.8977153e-10 ] [ 8.977066000000001e-11 3.0715536e-10 3.1722563e-10 ] [ 2.6858099e-10 1.0232005e-10 7.706528e-11 ] [ 2.7119343e-10 2.9839484e-10 1.857756e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.6e-06 -2.16e-05 -1.93e-05 ] [ 4.2e-06 -1e-06 4.5e-06 ] [ -3.5e-06 3.77e-05 2.4e-05 ] [ 2.24e-05 -1.5e-06 -3.1e-06 ] [ -1.45e-05 -1.36e-05 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.377871893888e-14 -3.460701500928e-14 -3.092200878144e-14 ] [ 6.72914180736e-15 -1.6021766208e-15 7.2097947936e-15 ] [ -5.6076181728e-15 6.040205860416e-14 3.84522388992e-14 ] [ 3.588875630592e-14 -2.4032649312e-15 -4.96674752448e-15 ] [ -2.32315610016e-14 -2.178960204288e-14 -9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.5709627 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.373219605568885e-18 } }