{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.9584148e-10 1.6379137e-10 5.879593e-11 ] [ 4.4983333e-10 -3.4109083e-10 -1.1432635e-10 ] [ 4.6712674e-10 4.8464727e-10 4.4946064e-10 ] ] "source-value" [ [ -3.9584148 1.6379137 0.5879593 ] [ 4.4983333 -3.4109083 -1.1432635 ] [ 4.6712674 4.8464727 4.4946064 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -8.010883104e-16 -6.408706483200001e-16 ] [ 0.0 8.010883104e-16 6.408706483200001e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 -5e-07 -4e-07 ] [ 0.0 5e-07 4e-07 ] ] } "species" { "source-value" [ "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" 4.488200919843366e-31 "source-value" 2.8013147e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.654636561720724e-08 1.881629869176557e-09 -2.039123350348211e-09 ] [ 8.048532171759193e-09 -1.477915326879318e-08 -8.415744163887085e-09 ] [ 8.497833445448055e-09 1.289752339961662e-08 1.045486751423529e-08 ] ] "source-value" [ [ -10.3274292 1.174421 -1.2727207 ] [ 5.0234987 -9.224422 -5.2526944 ] [ 5.3039305 8.050001 6.5254151 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.508296540545074e-18 "source-value" 28.138574 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.825979e-11 1.1474e-10 1.105023e-10 ] [ 2.41217e-10 9.952408000000001e-12 8.207382e-11 ] [ 2.516418e-10 1.826554e-10 2.013541e-10 ] ] "source-value" [ [ 0.2825979 1.1474 1.105023 ] [ 2.41217 0.09952408 0.8207382 ] [ 2.516418 1.826554 2.013541 ] ] } "instance-id" 1 }