{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4923061 3.6921966 0.6650916 ] [ 3.5488445 -2.7619773 -1.6309437 ] [ -0.3640333 0.4726249 0.439019 ] [ -1.7717533 -4.3788547 0.0380613 ] [ 3.8512759 -0.4240802 2.5014239 ] [ 0.9751716 2.6791742 0.0311414 ] [ -2.7471993 0.7209164 -2.0437935 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.595291186097226e-09 5.915551071917249e-09 1.065594212210465e-09 ] [ 5.685875688754665e-09 -4.425175457240307e-09 -2.613059865981049e-09 ] [ -5.832456424526726e-10 7.57228565187938e-10 7.033859778869952e-10 ] [ -2.838661715085249e-09 -7.015698626220198e-09 6.098092501725504e-11 ] [ 6.170424207230479e-09 -6.794513817841882e-10 4.007722891290357e-09 ] [ 1.562397138788129e-09 4.292510266290543e-09 4.989402301898112e-11 ] [ -4.401498491138126e-09 1.155035401631301e-09 -3.274518163443005e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.311183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.773557268099041e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7971007 3.9118468 3.1383698 ] [ 5.8573024 2.1779534 1.424042 ] [ 3.6581947 1.2622809 0.9418503 ] [ 3.1429293 1.4415793 3.310266 ] [ 5.172844 2.8376659 3.7365414 ] [ 4.9412617 4.4935264 1.648418 ] [ 2.8497723 3.5377677 0.6667994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7971007e-10 3.911846800000001e-10 3.1383698e-10 ] [ 5.8573024e-10 2.1779534e-10 1.424042e-10 ] [ 3.6581947e-10 1.2622809e-10 9.418503e-11 ] [ 3.1429293e-10 1.4415793e-10 3.310266e-10 ] [ 5.172844000000001e-10 2.837665900000001e-10 3.7365414e-10 ] [ 4.9412617e-10 4.4935264e-10 1.648418e-10 ] [ 2.8497723e-10 3.5377677e-10 6.667994e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.57e-05 -2.87e-05 -1.46e-05 ] [ -4.7e-06 -1.04e-05 3.9e-06 ] [ 2.4e-06 2.64e-05 1.05e-05 ] [ -9.2e-06 1.22e-05 -1.51e-05 ] [ 3.6e-06 1.04e-05 2.9e-06 ] [ -1.52e-05 -4.9e-06 -7.5e-06 ] [ 7.5e-06 -5e-06 1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.515417294656e-14 -4.598246901696e-14 -2.339177866368e-14 ] [ -7.53023011776e-15 -1.666263685632e-14 6.24848882112e-15 ] [ 3.84522388992e-15 4.229746278912e-14 1.68228545184e-14 ] [ -1.474002491136e-14 1.954655477376e-14 -2.419286697408e-14 ] [ 5.76783583488e-15 1.666263685632e-14 4.646312200320001e-15 ] [ -2.435308463616e-14 -7.850665441919999e-15 -1.2016324656e-14 ] [ 1.2016324656e-14 -8.010883104e-15 3.188331475392e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }