{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9767338 -4.4247124 -0.7134926 ] [ -5.395842 3.1345943 -2.222459 ] [ -4.0292271 2.3904262 5.9158712 ] [ -2.0717235 0.2634291 -1.3800888 ] [ 10.5200587 -1.3637372 -1.5998308 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.564900059105143e-09 -7.089170761043858e-09 -1.143141162833806e-09 ] [ -8.645091901930714e-09 5.022173703152941e-09 -3.560771850486548e-09 ] [ -6.455533459513784e-09 3.829884971387785e-09 9.47827052830404e-09 ] [ -3.319266956461949e-09 4.220599452583853e-10 -2.211146009987927e-09 ] [ 1.685499209858364e-08 -2.184947858755254e-09 -2.563211504995761e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8624762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.259707554923643e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4589941 0.4029765 1.7675866 ] [ 0.856603 2.7459881 0.7395956 ] [ -0.7085227 2.4196507 2.6514414 ] [ 2.8104886 0.0689017 1.6219007 ] [ 3.1722669 2.2007924 0.686514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.589941000000001e-11 4.029765000000001e-11 1.7675866e-10 ] [ 8.566030000000001e-11 2.7459881e-10 7.395956e-11 ] [ -7.085227e-11 2.4196507e-10 2.6514414e-10 ] [ 2.8104886e-10 6.89017e-12 1.6219007e-10 ] [ 3.1722669e-10 2.2007924e-10 6.86514e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.9e-06 -2e-07 6e-06 ] [ -3.1e-06 -9.4e-06 -6.8e-06 ] [ -1.07e-05 4.7e-06 7.9e-06 ] [ -7e-07 -3.12e-05 3.7e-06 ] [ 2.43e-05 3.6e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.586154854592e-14 -3.2043532416e-16 9.6130597248e-15 ] [ -4.96674752448e-15 -1.506046023552e-14 -1.089480102144e-14 ] [ -1.714328984256e-14 7.53023011776e-15 1.265719530432e-14 ] [ -1.12152363456e-15 -4.998791056896e-14 5.928053496960001e-15 ] [ 3.893289188544e-14 5.76783583488e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.164352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.788726376078172e-18 } }