{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.6026833 -17.4076429 -17.0144638 ] [ 19.9371375 13.7472689 19.4500431 ] [ 2.7833801 9.2524493 -5.3089444 ] [ -4.5772092 3.5543971 5.5299702 ] [ 10.1867227 -8.8946066 -3.2236861 ] [ -0.7273478 -0.2518658 0.5670809 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.4224374218962e-08 -2.789011870739599e-08 -2.726017634039885e-08 ] [ 3.194281585134517e-08 2.202555301289488e-08 3.116240458511292e-08 ] [ 4.459466559760583e-09 1.482405807572966e-08 -8.505866668885149e-09 ] [ -7.333497629169833e-09 5.694771981577362e-09 8.859989041156306e-09 ] [ 1.632092908697739e-08 -1.425073086314218e-08 -5.164914544770587e-09 ] [ -1.165339649951305e-09 -4.035334996637171e-10 9.085637675676905e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 6.4060594807723925 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.02636388161077e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3762919 0.5239004 0.6035546 ] [ 2.9772333 1.810834 1.0884026 ] [ 1.2677449 3.0017236 0.0926956 ] [ -0.1527565 2.4976712 1.8420199 ] [ 1.8356059 0.0384798 0.0710726 ] [ 1.5412967 1.2644327 2.8122235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.762919e-11 5.239004e-11 6.035546e-11 ] [ 2.9772333e-10 1.810834e-10 1.0884026e-10 ] [ 1.2677449e-10 3.0017236e-10 9.26956e-12 ] [ -1.527565e-11 2.4976712e-10 1.8420199e-10 ] [ 1.8356059e-10 3.84798e-12 7.10726e-12 ] [ 1.5412967e-10 1.2644327e-10 2.8122235e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.76e-05 1.33e-05 4.87e-05 ] [ -2.66e-05 1.12e-05 1.41e-05 ] [ 1.74e-05 -2.37e-05 9.5e-06 ] [ 1.42e-05 -1.57e-05 -2.86e-05 ] [ -1.08e-05 3.28e-05 9.6e-06 ] [ -1.17e-05 -1.79e-05 -5.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.81983087584e-14 2.13089492322e-14 7.802600207579999e-14 ] [ -4.26178984644e-14 1.79443783008e-14 2.25906905394e-14 ] [ 2.78778734316e-14 -3.79715862258e-14 1.5220678023e-14 ] [ 2.27509082028e-14 -2.515417315379999e-14 -4.58222517324e-14 ] [ -1.73035076472e-14 5.255139359519999e-14 1.53808956864e-14 ] [ -1.87454666178e-14 -2.86789617486e-14 -8.53960145922e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.185693719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.593234028202703e-18 } }