{ "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" [ [ 1.111705 1.964485 2.063826 ] [ 1.996516 4.229048 2.317605 ] [ 3.494235 2.652341 1.536538 ] [ 4.5932 4.863032 2.072185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.111705e-10 1.964485e-10 2.063826e-10 ] [ 1.996516e-10 4.229048e-10 2.317605e-10 ] [ 3.494235e-10 2.652341e-10 1.536538e-10 ] [ 4.593200000000001e-10 4.863032e-10 2.072185e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9065217 1.493499 -0.1396824 ] [ 1.3896429 -0.1485664 -0.1974414 ] [ -0.4272123 0.5904561 0.4049739 ] [ -2.8689523 -1.9353886 -0.0678501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.054584494787871e-09 2.392849180988179e-09 -2.237958756172339e-10 ] [ 2.226453365640712e-09 -2.380296127164211e-10 -3.163359950580211e-10 ] [ -6.844695591781958e-10 9.46014959028747e-10 6.488397146141971e-10 ] [ -4.596568301250388e-09 -3.100834367082843e-09 -1.087078439389421e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.263343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.125021806825133e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5326985 2.1485495 2.3988244 ] [ 1.9807358 4.3842195 1.9879972 ] [ 3.426999 2.699769 1.1841174 ] [ 4.2552226 4.476368 2.419215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5326985e-10 2.1485495e-10 2.3988244e-10 ] [ 1.9807358e-10 4.384219500000001e-10 1.9879972e-10 ] [ 3.426999e-10 2.699769e-10 1.1841174e-10 ] [ 4.2552226e-10 4.476368e-10 2.419215e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 8.2e-06 -1e-06 ] [ -1e-06 -1.28e-05 1e-06 ] [ -4.8e-06 -7.8e-06 -7.2e-06 ] [ 7.7e-06 1.23e-05 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 1.313784829056e-14 -1.6021766208e-15 ] [ -1.6021766208e-15 -2.050786074624e-14 1.6021766208e-15 ] [ -7.69044777984e-15 -1.249697764224e-14 -1.153567166976e-14 ] [ 1.233675998016e-14 1.970677243584e-14 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.547552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.330774770427228e-18 } }