{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.4450221 -4.7421343 0.8557947 ] [ -9.7914226 6.0131086 9.6597147 ] [ 51.5738512 -127.0003387 -40.692815 ] [ 3.166274 -9.1202353 -0.523445 ] [ -43.5120965 82.6967155 -58.1226959 ] [ 12.008416 52.1528841 88.8234464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.154130007475932e-08 -7.597736708153774e-09 1.37113426054455e-09 ] [ -1.568758837409275e-08 9.63406201725142e-09 1.547656905593809e-08 ] [ 8.263041863725803e-08 -2.034769734988215e-07 -6.519707682753957e-08 ] [ 5.072930177846899e-09 -1.461222777385487e-08 -8.386513412746561e-10 ] [ -6.971406373429351e-08 1.32494744191049e-07 -9.3122824508848e-08 ] [ 1.923960336804065e-08 8.355813161231206e-08 1.423108492009619e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 42.232643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.766415324919278e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1604942 2.5263482 0.4479234 ] [ 0.6247967 1.7572466 2.7189496 ] [ 3.1819409 0.6899768 0.1074873 ] [ 1.8627473 -0.2951735 2.0620568 ] [ 2.3055583 3.0124171 0.2286568 ] [ 2.5219226 3.4205465 2.7090568 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.604942e-11 2.5263482e-10 4.479234e-11 ] [ 6.247967e-11 1.7572466e-10 2.7189496e-10 ] [ 3.1819409e-10 6.899768e-11 1.074873e-11 ] [ 1.8627473e-10 -2.951735e-11 2.0620568e-10 ] [ 2.3055583e-10 3.0124171e-10 2.286568e-11 ] [ 2.5219226e-10 3.4205465e-10 2.7090568e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -2.73e-05 -9.7e-06 ] [ 4.8e-06 -4e-06 6.7e-06 ] [ -9.9e-06 3.6e-06 -1.43e-05 ] [ -2.03e-05 -2.21e-05 1.21e-05 ] [ 2.44e-05 3.12e-05 5.3e-06 ] [ 8.2e-06 1.86e-05 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 -4.373942174784e-14 -1.554111322176e-14 ] [ 7.69044777984e-15 -6.4087064832e-15 1.073458335936e-14 ] [ -1.586154854592e-14 5.76783583488e-15 -2.291112567744e-14 ] [ -3.252418540224e-14 -3.540810331968e-14 1.938633711168e-14 ] [ 3.909310954752e-14 4.998791056896e-14 8.491536090240001e-15 ] [ 1.313784829056e-14 2.980048514688e-14 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586596703968e-18 } }