{ "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" [ [ -12.2552289 -14.1653751 -20.585094 ] [ -11.5676685 -5.4774425 9.4155508 ] [ -7.1014431 21.454307 21.9343244 ] [ 21.7896937 -17.8811543 3.8216904 ] [ 9.1346468 16.0696648 -14.5864716 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.96350412261325e-08 -2.269543281008247e-08 -3.298095634377036e-08 ] [ -1.85334480278646e-08 -8.775830315276306e-09 1.508537536371474e-08 ] [ -1.137776610876148e-08 3.437358909086579e-08 3.514266174672299e-08 ] [ 3.491093782053306e-08 -2.864876737237739e-08 6.1230230108158e-09 ] [ 1.463531754222553e-08 2.574644124665271e-08 -2.337010377748317e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.553555 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.851083570812694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8415835 -0.1917643 1.3908026 ] [ -0.3409942 1.1466647 2.9209561 ] [ 0.8553654 3.1508282 3.2095581 ] [ 2.7683559 0.985577 0.7330363 ] [ 2.7772788 3.0510845 1.8576885 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.415835e-11 -1.917643e-11 1.3908026e-10 ] [ -3.409942e-11 1.1466647e-10 2.9209561e-10 ] [ 8.553654e-11 3.1508282e-10 3.2095581e-10 ] [ 2.7683559e-10 9.855770000000001e-11 7.330363e-11 ] [ 2.7772788e-10 3.0510845e-10 1.8576885e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.52e-05 2.43e-05 -4.3e-06 ] [ 1.82e-05 -2.11e-05 -8.3e-06 ] [ 2.54e-05 -3.8e-06 -9.7e-06 ] [ 1.13e-05 -5.7e-06 2.97e-05 ] [ -2.98e-05 6.3e-06 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.037485084416e-14 3.893289188544e-14 -6.889359469440001e-15 ] [ 2.915961449856e-14 -3.380592669888e-14 -1.329806595264e-14 ] [ 4.069528616832e-14 -6.08827115904e-15 -1.554111322176e-14 ] [ 1.810459581504e-14 -9.13240673856e-15 4.758464563776e-14 ] [ -4.774486329984001e-14 1.009371271104e-14 -1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }