{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.667615000000001e-11 9.140018e-11 7.088642000000001e-11 ] [ 1.5635284e-10 6.3414416e-10 3.48061e-12 ] [ 6.4690388e-10 1.0035831e-10 9.969724e-11 ] [ 2.9992505e-10 1.1793808e-10 5.8167938e-10 ] [ 5.4959248e-10 5.6543657e-10 3.8190145e-10 ] ] "source-value" [ [ 0.9667615 0.9140018 0.7088642 ] [ 1.5635284 6.3414416 0.0348061 ] [ 6.4690388 1.0035831 0.9969724 ] [ 2.9992505 1.1793808 5.8167938 ] [ 5.4959248 5.6543657 3.8190145 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -1.6021766208e-16 -3.2043532416e-16 1.6021766208e-16 ] [ 1.6021766208e-16 3.2043532416e-16 -1.6021766208e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -1e-07 -2e-07 1e-07 ] [ 1e-07 2e-07 -1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.538112165694967e-33 "source-value" 5.3290705e-14 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.95497777122504e-08 -1.637475663957102e-08 -1.280193770263736e-08 ] [ -1.091046694422052e-08 2.048525259216156e-08 -1.285346113927969e-08 ] [ 2.03500125431645e-08 -1.386829326917803e-08 -1.011307357354341e-08 ] [ -4.882131129735041e-09 -1.357665354498834e-08 2.545882426752253e-08 ] [ 1.499236324304146e-08 2.333445102179349e-08 1.030964814793793e-08 ] ] "source-value" [ [ -12.2020116 -10.2203193 -7.9903411 ] [ -6.8097779 12.7858891 -8.0224995 ] [ 12.7014789 -8.6559079 -6.3120841 ] [ -3.0471866 -8.4738807 15.8901484 ] [ 9.3574972 14.5642189 6.4347763 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.585696490897402e-18 "source-value" 53.587703 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.666012e-10 2.519902e-10 1.694639e-10 ] [ 2.496155e-10 4.523544000000001e-10 1.233674e-10 ] [ 4.888558e-10 1.942791e-10 1.748689e-10 ] [ 3.394286e-10 2.23286e-10 3.870587e-10 ] [ 4.049493e-10 3.873676e-10 2.828862e-10 ] ] "source-value" [ [ 2.666012 2.519902 1.694639 ] [ 2.496155 4.523544 1.233674 ] [ 4.888558 1.942791 1.748689 ] [ 3.394286 2.23286 3.870587 ] [ 4.049493 3.873676 2.828862 ] ] } "instance-id" 1 }