{ "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" [ [ -7.0632161 -6.5029026 -7.3735388 ] [ -1.3136139 2.4122052 2.7905844 ] [ -7.6548258 5.4049895 10.0942707 ] [ 9.5836251 -14.1719721 3.3575979 ] [ 6.4480307 12.85768 -8.8689143 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.13165197963126e-08 -1.041879859889785e-08 -1.18137115752524e-08 ] [ -2.104641496677612e-09 3.864778807853297e-09 4.47100912088491e-09 ] [ -1.226438303410036e-08 8.659747883915342e-09 1.617280465281082e-08 ] [ 1.535466020423591e-08 -2.270600255631991e-08 5.379464901747469e-09 ] [ 1.033088412285466e-08 2.060027446344912e-08 -1.420956726040846e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.13335895363115036 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.136645994425185e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.6299921 1.2005807 0.8849264 ] [ 0.4052017 0.5525262 3.0653354 ] [ 0.962785 2.7530333 2.7975503 ] [ 2.5615657 0.9239256 2.3889948 ] [ 2.3420449 2.7123243 0.9752346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.299921000000001e-11 1.2005807e-10 8.849264000000001e-11 ] [ 4.052017e-11 5.525262e-11 3.0653354e-10 ] [ 9.62785e-11 2.7530333e-10 2.7975503e-10 ] [ 2.5615657e-10 9.239256000000001e-11 2.3889948e-10 ] [ 2.3420449e-10 2.7123243e-10 9.752346e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.25e-05 5.16e-05 0.0002767 ] [ 5.67e-05 8.65e-05 -0.0001225 ] [ 5.21e-05 -0.0002274 -0.000187 ] [ -0.0001351 6.62e-05 -9.4e-06 ] [ -6.1e-06 2.31e-05 4.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.207074060499999e-14 8.267231431439999e-14 4.433222746277999e-13 ] [ 9.08434151478e-14 1.38588278841e-13 -1.962666376649999e-13 ] [ 8.347340263139999e-14 -3.643349665716e-13 -2.996070305579999e-13 ] [ -2.164540632534e-13 1.060640931708e-13 -1.50604603596e-14 ] [ -9.773277467399999e-15 3.70102802454e-14 6.761185395480001e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.92419804636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070684812308062e-18 } }