{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0350973 2.432676 1.699297 ] [ 2.982994 0.1541281 0.8678609 ] [ 1.761148 2.120053 0.4355543 ] [ 1.533994 1.582134 2.799495 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.50973e-12 2.432676e-10 1.699297e-10 ] [ 2.982994e-10 1.541281e-11 8.678609000000001e-11 ] [ 1.761148e-10 2.120053e-10 4.355543e-11 ] [ 1.533994e-10 1.582134e-10 2.799495e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7984789 2.8855095 -1.3170202 ] [ -0.7589662 0.6643772 1.2227568 ] [ 2.4212766 -0.1485109 -2.3063129 ] [ 5.1361686 -3.4013758 2.4005763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089236404032202e-08 4.623095898085023e-09 -2.110098990946007e-09 ] [ -1.215997911635771e-09 1.064449626002345e-09 1.959072374024611e-09 ] [ 3.879312792970964e-09 -2.379406938743106e-10 -3.695120639072778e-09 ] [ 8.229049319204493e-09 -5.449604830213056e-09 3.846147255994174e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9888402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.440170973519989e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1177278 2.509226 1.6988598 ] [ 2.9241116 0.2126453 1.0550526 ] [ 1.7906548 2.16361 0.3443443 ] [ 1.7161946 1.4035098 2.7039504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.177278e-11 2.509226e-10 1.6988598e-10 ] [ 2.9241116e-10 2.126453e-11 1.0550526e-10 ] [ 1.7906548e-10 2.16361e-10 3.443443e-11 ] [ 1.7161946e-10 1.4035098e-10 2.7039504e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 2.7e-06 -3e-07 ] [ -8e-07 3.9e-06 -8.6e-06 ] [ 7.2e-06 -1.14e-05 1.05e-05 ] [ 3e-07 4.8e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.08948011112e-14 4.3258769118e-15 -4.806529901999999e-16 ] [ -1.2817413072e-15 6.248488872599999e-15 -1.37787190524e-14 ] [ 1.15356717648e-14 -1.82648136276e-14 1.6822854657e-14 ] [ 4.806529901999999e-16 7.690447843199998e-15 -2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }