{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0440566 3.0246384 2.6862851 ] [ 1.2505174 -1.6378034 4.586274 ] [ -1.7554604 -1.2935431 -6.927242 ] [ -0.5391136 -0.0932919 -0.3453172 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.672763075311937e-09 4.846004930853919e-09 4.30390318402339e-09 ] [ 2.003549742183602e-09 -2.624050316946751e-09 7.3480209793829e-09 ] [ -2.812557611620216e-09 -2.072484512817157e-09 -1.109866517902383e-08 ] [ -8.637552058753229e-10 -1.494701010900115e-10 -5.532591446001178e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4929183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.520933176342448e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6719254 2.5067252 0.9987963 ] [ 1.4488722 4.5642689 0.866597 ] [ 2.8163203 4.4894511 2.8341593 ] [ 4.0393281 2.4318838 2.9663911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6719254e-10 2.5067252e-10 9.987963e-11 ] [ 1.4488722e-10 4.5642689e-10 8.66597e-11 ] [ 2.8163203e-10 4.4894511e-10 2.8341593e-10 ] [ 4.0393281e-10 2.4318838e-10 2.9663911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 -5.86e-05 -4.79e-05 ] [ -1.68e-05 1.65e-05 -2.79e-05 ] [ 1.7e-06 5.77e-05 6.61e-05 ] [ 2.62e-05 -1.56e-05 9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.778416049088e-14 -9.388754997888e-14 -7.674426013632e-14 ] [ -2.691656722944e-14 2.64359142432e-14 -4.470072772032e-14 ] [ 2.72370025536e-15 9.244559102016e-14 1.0590387463488e-13 ] [ 4.197702746496e-14 -2.499395528448e-14 1.554111322176e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455470481064e-18 } }