{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0366596 0.3031896 0.5717068 ] [ 1.2473658 0.8179226 -0.7058974 ] [ -0.1181463 -0.1613759 -0.1269377 ] [ 1.2139943 -0.7612828 -1.6227477 ] [ -1.3065542 -0.1984534 1.883876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.66091177484788e-09 4.857632887897037e-10 9.159752689123814e-10 ] [ 1.998500322345489e-09 1.31045646734395e-09 -1.130972310963506e-09 ] [ -1.89291239694023e-10 -2.585526941405587e-10 -2.033766152381241e-10 ] [ 1.945033285244462e-09 -1.219709503977162e-09 -2.599928426396972e-09 ] [ -2.093330593048047e-09 -3.179573977982707e-10 3.018302083686221e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.284492 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609063236400464e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2892565 2.4797487 1.6496321 ] [ 2.2078535 1.4522009 3.7462922 ] [ 2.5846121 4.6676499 2.4140368 ] [ 4.5364005 2.0287195 1.1964407 ] [ 3.9299933 2.952603 3.2548782 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2892565e-10 2.4797487e-10 1.6496321e-10 ] [ 2.2078535e-10 1.4522009e-10 3.7462922e-10 ] [ 2.5846121e-10 4.667649899999999e-10 2.4140368e-10 ] [ 4.5364005e-10 2.0287195e-10 1.1964407e-10 ] [ 3.9299933e-10 2.952603e-10 3.2548782e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.46e-05 1.24e-05 1.41e-05 ] [ 1.58e-05 -6.3e-06 -2.35e-05 ] [ -1.16e-05 9.1e-06 -9.6e-06 ] [ -1.94e-05 -1.8e-05 6.2e-06 ] [ 7e-07 2.8e-06 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.339177866368e-14 1.986699009792e-14 2.259069035328e-14 ] [ 2.531439060864e-14 -1.009371271104e-14 -3.76511505888e-14 ] [ -1.858524880128e-14 1.457980724928e-14 -1.538089555968e-14 ] [ -3.108222644352e-14 -2.88391791744e-14 9.93349504896e-15 ] [ 1.12152363456e-15 4.48609453824e-15 2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.98308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.720989372517607e-18 } }