{ "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" [ [ -11.639617 -6.4121819 -16.1294165 ] [ -2.6053239 1.5734089 3.7730419 ] [ -12.389123 15.5268769 19.6543673 ] [ 21.4958964 -21.278754 7.4977765 ] [ 5.1381676 10.5906502 -14.7957693 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.864872223246623e-08 -1.027344792849692e-08 -2.584217402344577e-08 ] [ -4.174189042191478e-09 2.520878954538645e-09 6.045079521478812e-09 ] [ -1.984956322281556e-08 2.487679916321958e-08 3.148976778467602e-08 ] [ 3.444022265521888e-08 -3.409232217855448e-08 1.201276221628365e-08 ] [ 8.232252002472046e-09 1.696809214951085e-08 -2.370543565921039e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7304296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.181160332260296e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8090431 0.9318937 0.7743656 ] [ 0.1960519 0.705351 3.001218 ] [ 1.2460093 2.7746353 3.0409777 ] [ 2.4533678 0.9447742 2.3713879 ] [ 2.1971174 2.7857359 0.9240923 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.090431e-11 9.318937000000001e-11 7.743656e-11 ] [ 1.960519e-11 7.05351e-11 3.001218000000001e-10 ] [ 1.2460093e-10 2.7746353e-10 3.0409777e-10 ] [ 2.4533678e-10 9.447742e-11 2.3713879e-10 ] [ 2.1971174e-10 2.7857359e-10 9.240923e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.09e-05 2.13e-05 0.0001412 ] [ 0.0001046 -4.36e-05 -4.16e-05 ] [ -2.84e-05 -7.18e-05 -0.0001261 ] [ -0.0001135 6.14e-05 -9.1e-06 ] [ 0.0001183 3.27e-05 3.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2961608862272e-13 3.412636202304e-14 2.2622733885696e-13 ] [ 1.6758767453568e-13 -6.985490066688e-14 -6.665054742528e-14 ] [ -4.550181603071999e-14 -1.1503628137344e-13 -2.0203447188288e-13 ] [ -1.818470464608e-13 9.837364451712e-14 -1.457980724928e-14 ] [ 1.8953749424064e-13 5.239117550016001e-14 5.703748770048e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }