{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0329549 -3.114683 -5.3408166 ] [ -3.5135453 -3.7932254 3.9289805 ] [ -5.1165012 2.9503632 -2.6728037 ] [ 3.4605259 7.6662709 1.8404793 ] [ 3.1365658 -3.7087257 2.2441605 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.257152811920802e-09 -4.990272283803207e-09 -8.556931492500545e-09 ] [ -5.629320135781723e-09 -6.077417053304728e-09 6.294920700679094e-09 ] [ -8.197538602935145e-09 4.727002941908675e-09 -4.282303600127736e-09 ] [ 5.544373692652878e-09 1.228272000469938e-08 2.948772905526349e-09 ] [ 5.025332394360849e-09 -5.942033609500115e-09 3.595541486422838e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8268479 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.093781609913758e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1270626 1.3151434 1.0159731 ] [ 0.7917605 1.2243785 3.2489196 ] [ 0.9593419 3.4181663 1.9207326 ] [ 2.8454628 4.3356736 3.08593 ] [ 3.24961 1.9750831 3.2316557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1270626e-10 1.3151434e-10 1.0159731e-10 ] [ 7.917605e-11 1.2243785e-10 3.2489196e-10 ] [ 9.593419e-11 3.4181663e-10 1.9207326e-10 ] [ 2.8454628e-10 4.3356736e-10 3.08593e-10 ] [ 3.24961e-10 1.9750831e-10 3.2316557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 -2.2e-06 7e-07 ] [ 2.8e-06 -1.9e-06 6.2e-06 ] [ -1.63e-05 1.51e-05 -7.4e-06 ] [ 1.9e-06 -7e-07 3e-07 ] [ 2.3e-06 -1.03e-05 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 -3.52478856576e-15 1.12152363456e-15 ] [ 4.48609453824e-15 -3.04413557952e-15 9.93349504896e-15 ] [ -2.611547891904e-14 2.419286697408e-14 -1.185610699392e-14 ] [ 3.04413557952e-15 -1.12152363456e-15 4.8065298624e-16 ] [ 3.68500622784e-15 -1.650241919424e-14 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }