{ "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" [ [ 0.7872548 2.971705 2.821442 ] [ 1.838331 0.4014098 1.675971 ] [ 2.974058 1.714847 0.8061894 ] [ 1.598524 2.494897 0.1079685 ] [ 2.930835 1.52262 2.533969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 1.838331e-10 4.014098e-11 1.675971e-10 ] [ 2.974058e-10 1.714847e-10 8.061894e-11 ] [ 1.598524e-10 2.494897e-10 1.079685e-11 ] [ 2.930835e-10 1.52262e-10 2.533969e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -17.1513307 -19.9607291 -2.9220748 ] [ 19.2544673 2.3347251 -18.7179037 ] [ -13.579714 9.1419033 -9.0139542 ] [ 11.4765775 8.4841007 30.6539327 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -2.74794610631493e-08 -3.198061349814223e-08 -4.681679928788836e-09 ] [ 3.08490573540181e-08 3.740641971214942e-09 -2.998938769852582e-08 ] [ -2.175710028795045e-08 1.464694373687437e-08 -1.444194668020197e-08 ] [ 1.838750415729931e-08 1.359302779005292e-08 4.911301430751662e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.6893299 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.39218412161984e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7872548 2.971705 2.821442 ] [ 2.0425911 -0.7723356 3.5904911 ] [ 2.5398609 2.3452003 0.5444004 ] [ 2.3094735 3.7301883 -1.1499351 ] [ 2.4498225 0.8307208 2.1391415 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 2.0425911e-10 -7.723356e-11 3.5904911e-10 ] [ 2.5398609e-10 2.3452003e-10 5.444004000000001e-11 ] [ 2.3094735e-10 3.7301883e-10 -1.1499351e-10 ] [ 2.4498225e-10 8.307208e-11 2.1391415e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0026712 0.0028004 -0.0010485 ] [ -0.0022357 0.0049012 -0.0070588 ] [ 0.0024541 -0.0010454 0.0029992 ] [ -0.0028896 -0.0066562 0.005108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 4.279734189480959e-12 4.48673540888832e-12 -1.6798821869088e-12 ] [ -3.581986271122561e-12 7.85258805386496e-12 -1.130944433090304e-11 ] [ 3.93190164510528e-12 -1.67491543938432e-12 4.805248121103361e-12 ] [ -4.62964956346368e-12 -1.066440802336896e-11 8.1839181790464e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.4173403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.348606583797766e-18 } }