{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2785945 -4.024617 -3.5480652 ] [ -6.3587478 -15.9287503 14.99999 ] [ -13.5820834 2.8629568 -5.2997071 ] [ 3.4454679 -3.3393291 -13.4867768 ] [ 5.0199311 -0.4332192 12.1734665 ] [ 7.2855365 12.2690626 -15.8622623 ] [ 6.4684901 8.5938961 11.0233548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.650710866260913e-09 -6.448147318199178e-09 -5.684627159348536e-09 ] [ -1.01878371466589e-08 -2.552067153948049e-08 2.403263348823366e-08 ] [ -2.176089666451927e-08 4.586962489111411e-09 -8.4910668826639e-09 ] [ 5.520248162577048e-09 -5.350195057256249e-09 -2.160819865693329e-08 ] [ 8.042816312709917e-09 -6.940936796401727e-10 1.950404358108176e-08 ] [ 1.167271634645414e-08 1.965720541880329e-08 -2.541414601943909e-08 ] [ 1.036366369548032e-08 1.376893952644373e-08 1.766136148885174e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6798488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.230447430001294e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7304619 1.9648151 1.5533462 ] [ 2.817762 2.5048391 4.0429047 ] [ 1.9091951 4.2673148 2.2752654 ] [ 4.9757976 2.8646809 1.2964881 ] [ 5.3222553 2.8362783 3.7040647 ] [ 4.1323794 5.1444458 1.3891234 ] [ 3.8882336 4.9327459 3.9175076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7304619e-10 1.9648151e-10 1.5533462e-10 ] [ 2.817762e-10 2.5048391e-10 4.0429047e-10 ] [ 1.9091951e-10 4.267314800000001e-10 2.2752654e-10 ] [ 4.9757976e-10 2.8646809e-10 1.2964881e-10 ] [ 5.322255300000001e-10 2.8362783e-10 3.7040647e-10 ] [ 4.1323794e-10 5.1444458e-10 1.3891234e-10 ] [ 3.8882336e-10 4.9327459e-10 3.9175076e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 -4.9e-06 -2e-06 ] [ 1.8e-06 2.8e-06 1.3e-06 ] [ -2e-07 -2e-06 -8.6e-06 ] [ -8.7e-06 2.9e-06 4.6e-06 ] [ 2e-07 -2.8e-06 3.4e-06 ] [ -3.2e-06 6.6e-06 -2.3e-06 ] [ 8.3e-06 -2.6e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.7237002778e-15 -7.850665506599998e-15 -3.204353268e-15 ] [ 2.8839179412e-15 4.486094575199999e-15 2.0828296242e-15 ] [ -3.204353268e-16 -3.204353268e-15 -1.37787190524e-14 ] [ -1.39389367158e-14 4.6463122386e-15 7.370012516399999e-15 ] [ 3.204353268e-16 -4.486094575199999e-15 5.4474005556e-15 ] [ -5.1269652288e-15 1.05743657844e-14 -3.685006258199999e-15 ] [ 1.32980660622e-14 -4.165659248399999e-15 5.767835882399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.473824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.799615251942842e-18 } }