{ "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" [ [ -57.6040114 -1.2028538 65.6796142 ] [ 7.9248653 5.2630878 -52.1727192 ] [ -0.768999 -12.3016333 -6.3420923 ] [ -15.5720866 -6.9330476 15.0693552 ] [ 29.6261998 -7.9665069 87.2989934 ] [ 37.3994555 20.8363513 -44.2297831 ] [ -1.0054236 2.3046024 -65.3033681 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.229180108974961e-08 -1.927184252478109e-09 1.052303432013746e-07 ] [ 1.26970340112574e-08 8.432396295850465e-09 -8.358991163448316e-08 ] [ -1.232072229369366e-09 -1.970938943329631e-08 -1.016115209373132e-08 ] [ -2.49492332931445e-08 -1.110796686712978e-08 2.414376879088639e-08 ] [ 4.746640507377547e-08 -1.276375120977977e-08 1.398684073972002e-07 ] [ 5.992053372642279e-08 3.338351519067552e-08 -7.086392500970808e-08 ] [ -1.610866199192162e-09 3.692380115940321e-09 -1.04627530491321e-07 ] ] } "unrelaxed-potential-energy" { "source-value" -5.104998276367169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.179108955005752e-19 } "relaxed-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 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -57.6040114 -1.2028538 65.6796142 ] [ 7.9248653 5.2630878 -52.1727192 ] [ -0.768999 -12.3016333 -6.3420923 ] [ -15.5720866 -6.9330476 15.0693552 ] [ 29.6261998 -7.9665069 87.2989934 ] [ 37.3994555 20.8363513 -44.2297831 ] [ -1.0054236 2.3046024 -65.3033681 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.229180108974961e-08 -1.927184252478109e-09 1.052303432013746e-07 ] [ 1.26970340112574e-08 8.432396295850465e-09 -8.358991163448316e-08 ] [ -1.232072229369366e-09 -1.970938943329631e-08 -1.016115209373132e-08 ] [ -2.49492332931445e-08 -1.110796686712978e-08 2.414376879088639e-08 ] [ 4.746640507377547e-08 -1.276375120977977e-08 1.398684073972002e-07 ] [ 5.992053372642279e-08 3.338351519067552e-08 -7.086392500970808e-08 ] [ -1.610866199192162e-09 3.692380115940321e-09 -1.04627530491321e-07 ] ] } "relaxed-potential-energy" { "source-value" -5.104998276367169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.179108955005752e-19 } }