{ "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" [ [ 2.635738 2.275834 0.8013506 ] [ 2.939619 0.762978 3.027642 ] [ 4.571028 2.353947 2.00113 ] [ 3.548969 3.060298 4.401477 ] [ 3.268552 4.224197 2.762666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.635738e-10 2.275834e-10 8.013506000000001e-11 ] [ 2.939619e-10 7.629780000000001e-11 3.027642e-10 ] [ 4.571028e-10 2.353947e-10 2.00113e-10 ] [ 3.548969e-10 3.060298e-10 4.401477e-10 ] [ 3.268552e-10 4.224197e-10 2.762666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.381476 -0.3104049 0.8498819 ] [ 0.4680662 1.6496222 -0.7224783 ] [ 0.1812275 -0.4146324 0.8157537 ] [ 0.6471809 -3.8613361 3.6819726 ] [ -0.9149985 2.9367512 -4.6251299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.111919285963008e-10 -4.973234737617619e-10 1.361660910621084e-09 ] [ 7.499247226266969e-10 2.642986121992662e-09 -1.157537841295329e-09 ] [ 2.903584635460321e-10 -6.643143375061939e-10 1.306981506471097e-09 ] [ 1.036898107408303e-09 -6.186542424471051e-09 5.89917041814619e-09 ] [ -1.465989204767069e-09 4.705194113746345e-09 -7.410274993943043e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.533486399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.661269298769011e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5775792 2.3639881 1.1189902 ] [ 2.9519579 0.9336713 2.9508812 ] [ 4.6731316 2.3814776 2.2169702 ] [ 3.5678091 2.7839 4.2696572 ] [ 3.1934282 4.214217 2.4377668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5775792e-10 2.3639881e-10 1.1189902e-10 ] [ 2.9519579e-10 9.336713000000001e-11 2.9508812e-10 ] [ 4.6731316e-10 2.381477600000001e-10 2.2169702e-10 ] [ 3.5678091e-10 2.7839e-10 4.2696572e-10 ] [ 3.1934282e-10 4.214217e-10 2.4377668e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-06 -1e-07 5e-06 ] [ 1.9e-06 2.5e-06 -1.7e-06 ] [ -4.6e-06 8e-07 8e-07 ] [ -1.6e-06 6e-07 -5.3e-06 ] [ 2.4e-06 -3.8e-06 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-15 -1.6021766208e-16 8.010883104e-15 ] [ 3.04413557952e-15 4.005441552e-15 -2.72370025536e-15 ] [ -7.370012455680001e-15 1.28174129664e-15 1.28174129664e-15 ] [ -2.56348259328e-15 9.6130597248e-16 -8.491536090240001e-15 ] [ 3.84522388992e-15 -6.08827115904e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }