{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.107976 2.819188 1.252407 ] [ 2.630591 3.411672 3.024039 ] [ 3.968262 4.362454 1.692316 ] [ 3.394725 3.292047 0.1208017 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107976e-10 2.819188e-10 1.252407e-10 ] [ 2.630591e-10 3.411672e-10 3.024039e-10 ] [ 3.968262e-10 4.362454e-10 1.692316e-10 ] [ 3.394725e-10 3.292047e-10 1.208017e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.6313901 1.1852806 -1.1475651 ] [ -2.2542625 -1.7456324 0.0606111 ] [ 2.8375678 3.4073374 1.0071656 ] [ -5.2146955 -2.8469857 0.0797884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.420305001158922e-09 1.8990288820535e-09 -1.838601989213873e-09 ] [ -3.611726704402424e-09 -2.796811442833342e-09 9.710968818103738e-11 ] [ 4.546284826550785e-09 5.459156366434311e-09 1.61365719088859e-09 ] [ -8.354863283524947e-09 -4.561373965872133e-09 1.278351101442456e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.439204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672544872635934e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3837978 2.6713795 1.2564345 ] [ 2.4223617 3.5583115 3.108197 ] [ 4.1588853 4.2860516 1.7856884 ] [ 3.1365092 3.3696184 -0.0607562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3837978e-10 2.6713795e-10 1.2564345e-10 ] [ 2.4223617e-10 3.5583115e-10 3.108197e-10 ] [ 4.1588853e-10 4.2860516e-10 1.7856884e-10 ] [ 3.1365092e-10 3.3696184e-10 -6.075620000000001e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.99e-05 -7.33e-05 -0.0005912 ] [ -0.000639 -5.4e-05 0.0016567 ] [ 0.0006327 0.000238 -0.0006041 ] [ -6.36e-05 -0.0001107 -0.0004614 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.119921467166e-13 -1.174395472722e-13 -9.472068260207998e-13 ] [ -1.023790869126e-12 -8.651753823599998e-14 2.6543260295478e-12 ] [ 1.0136971563318e-12 3.81318038892e-13 -9.678749045993999e-13 ] [ -1.018984339224e-13 -1.773609533838e-13 -7.392442989276e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.856289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.899586920175123e-18 } }