{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2243957 7.5652776 2.442419 ] [ -1.1558658 -5.3257101 -2.0887961 ] [ 0.859734 -3.9700918 0.6682023 ] [ -0.9329757 -1.5051408 -0.9731418 ] [ 2.1468555 -2.8037513 2.2233057 ] [ -1.1421436 6.0394164 -2.2719891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.595215443480506e-10 1.212091090058193e-08 3.913186619997716e-09 ] [ -1.851901161542289e-09 -8.53272821137843e-09 -3.346620277038219e-09 ] [ 1.377445714906867e-09 -6.36078826438979e-09 1.070578103024788e-09 ] [ -1.494791854314514e-09 -2.411501400772208e-09 -1.559145040683229e-09 ] [ 3.439641690335895e-09 -4.492104783397608e-09 3.562128413431379e-09 ] [ -1.829915773516347e-09 9.676211759356103e-09 -3.640127818732433e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.854365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.379931631982979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2075533 1.3589861 2.899188 ] [ 3.1466296 2.0945154 4.9478641 ] [ 1.4964522 3.5081403 2.4319094 ] [ 4.3413158 1.8463327 1.9884214 ] [ 5.378865 2.1960544 4.109208 ] [ 3.6938512 3.8887062 3.2870322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2075533e-10 1.3589861e-10 2.899188e-10 ] [ 3.1466296e-10 2.0945154e-10 4.9478641e-10 ] [ 1.4964522e-10 3.5081403e-10 2.4319094e-10 ] [ 4.3413158e-10 1.8463327e-10 1.9884214e-10 ] [ 5.378865e-10 2.1960544e-10 4.109208e-10 ] [ 3.6938512e-10 3.8887062e-10 3.2870322e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.06e-05 0.0001291 1.27e-05 ] [ -7.4e-06 7.7e-06 2.82e-05 ] [ 4.3e-06 -1.5e-06 -7e-06 ] [ 2.54e-05 -2.21e-05 -1.85e-05 ] [ 3.3e-06 4.6e-06 -2.3e-05 ] [ -8.63e-05 -0.0001179 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.709190322048001e-14 2.0684100174528e-13 2.034764308416e-14 ] [ -1.185610699392e-14 1.233675998016e-14 4.518138070656001e-14 ] [ 6.889359469440001e-15 -2.4032649312e-15 -1.12152363456e-14 ] [ 4.069528616832e-14 -3.540810331968e-14 -2.96402674848e-14 ] [ 5.28718284864e-15 7.370012455680001e-15 -3.68500622784e-14 ] [ -1.3826784237504e-13 -1.8889662359232e-13 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.615194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.822265199765643e-18 } }