{ "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" [ [ 1.2425959 0.8728002 -0.11263 ] [ 0.1121751 0.9306239 0.3306822 ] [ 0.5624642 -0.4903808 -0.1659901 ] [ -1.9172352 -1.3130433 -0.0520621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9908581164842e-09 1.398380086590527e-09 -1.8045315428742e-10 ] [ 1.797243241366134e-10 1.491023867621952e-09 5.298112941197147e-10 ] [ 9.011669987015026e-10 -7.856766595222271e-10 -2.659454596953234e-10 ] [ -3.071749439322316e-09 -2.103727294690252e-09 -8.341268013697139e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8015672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.57038419444208e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3934695 2.0947061 2.2530159 ] [ 1.9769555 4.3851819 2.1562666 ] [ 3.4963746 2.6194169 1.3050927 ] [ 4.3288564 4.6096011 2.2757789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3934695e-10 2.0947061e-10 2.2530159e-10 ] [ 1.9769555e-10 4.3851819e-10 2.1562666e-10 ] [ 3.496374600000001e-10 2.6194169e-10 1.3050927e-10 ] [ 4.328856400000001e-10 4.6096011e-10 2.2757789e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.65e-05 1.71e-05 1.22e-05 ] [ -1.57e-05 -9.4e-06 -1.28e-05 ] [ -3.1e-06 4.3e-06 -1.23e-05 ] [ 2.3e-06 -1.2e-05 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.6435914461e-14 2.73972204414e-14 1.95465549348e-14 ] [ -2.515417315379999e-14 -1.50604603596e-14 -2.05078609152e-14 ] [ -4.9667475654e-15 6.8893595262e-15 -1.97067725982e-14 ] [ 3.685006258199999e-15 -1.9226119608e-14 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827071333901e-18 } }