{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 17.3933855 -23.5227511 -19.0931773 ] [ -7.7852447 33.516015 17.4115501 ] [ 5.7416651 -0.3182348 -0.8158226 ] [ -2.2771209 -4.8615384 5.51821 ] [ -3.2107142 -1.4143238 -7.659648 ] [ -7.9916497 6.1270166 1.1250953 ] [ -1.8703211 -9.5261835 3.5137924 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.786727560466172e-08 -3.768760186931749e-08 -3.059064228684927e-08 ] [ -1.247333704554711e-08 5.369857565538212e-08 2.78963785021079e-08 ] [ 9.199161587683293e-09 -5.098683564849639e-10 -1.30709189644027e-09 ] [ -3.648349868715054e-09 -7.789043165601438e-09 8.841147050664768e-09 ] [ -5.144131227310576e-09 -2.265996526601015e-09 -1.227210894915748e-08 ] [ -1.280403431096333e-08 9.816562751773507e-09 1.802601385831962e-09 ] [ -2.996584739808939e-09 -1.526262848915072e-08 5.629716033624722e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.765573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.730276489011573e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3800489 1.350473 2.1403652 ] [ 1.384899 3.2178183 2.7782936 ] [ 2.5776439 2.0523271 4.2223533 ] [ 3.1186812 3.3013057 1.4103446 ] [ 4.5156436 2.8406356 4.9380273 ] [ 4.3147917 2.1359768 2.8517467 ] [ 3.3177096 4.0069465 3.4909152 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3800489e-10 1.350473e-10 2.1403652e-10 ] [ 1.384899e-10 3.2178183e-10 2.7782936e-10 ] [ 2.5776439e-10 2.0523271e-10 4.2223533e-10 ] [ 3.1186812e-10 3.3013057e-10 1.4103446e-10 ] [ 4.5156436e-10 2.8406356e-10 4.938027300000001e-10 ] [ 4.3147917e-10 2.1359768e-10 2.8517467e-10 ] [ 3.3177096e-10 4.0069465e-10 3.4909152e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.75e-05 6.3e-06 2.65e-05 ] [ 2.9e-06 -4.37e-05 2.91e-05 ] [ 1.4e-06 -3.7e-06 -6.49e-05 ] [ -1.23e-05 8.5e-06 1.8e-05 ] [ -5.07e-05 1.69e-05 2.76e-05 ] [ 4.34e-05 -4.53e-05 -3.59e-05 ] [ 4.28e-05 6.09e-05 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.4059857072e-14 1.009371271104e-14 4.24576804512e-14 ] [ 4.646312200320001e-15 -7.001511832895999e-14 4.662333966527999e-14 ] [ 2.24304726912e-15 -5.928053496960001e-15 -1.0398126268992e-13 ] [ -1.970677243584e-14 1.36185012768e-14 2.88391791744e-14 ] [ -8.123035467456e-14 2.707678489152e-14 4.422007473408001e-14 ] [ 6.953446534272e-14 -7.257860092224001e-14 -5.751814068672e-14 ] [ 6.857315937023999e-14 9.757255620672e-14 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }