{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.37222 -11.5932903 1.5900887 ] [ -5.0296778 -0.213909 -5.9459048 ] [ -3.6314097 1.3399262 3.8349536 ] [ 6.3686992 10.7747881 -2.9979729 ] [ 1.0136111 -2.5356936 2.6344157 ] [ 1.2535242 0.4000506 -1.5677649 ] [ 4.3974731 1.828128 2.4521845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.005068722707479e-09 -1.857449882983885e-08 2.547602961127435e-09 ] [ -8.058432247708524e-09 -3.42720001602306e-10 -9.526389738548444e-09 ] [ -5.818159769820949e-09 2.146798448924411e-09 6.144273050394182e-09 ] [ 1.020378104721449e-08 1.726311373012125e-08 -4.803282129745219e-09 ] [ 1.623984020383037e-09 -4.062629036903343e-09 4.220799278782754e-09 ] [ 2.008367183393542e-09 6.409517237376803e-10 -2.511836290385346e-09 ] [ 7.045528649463545e-09 2.928983965561152e-09 3.928832708156972e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.868072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.901474764902965e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7505036 0.3499739 2.0519996 ] [ 1.2684416 2.3282064 2.6076766 ] [ 1.5476245 2.7053143 4.9053673 ] [ 3.5359899 2.7557872 1.5616933 ] [ 3.1930563 0.9477589 5.6941904 ] [ 4.5051971 1.4640726 3.5529728 ] [ 3.9785349 3.3535737 5.2038751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7505036e-10 3.499739e-11 2.0519996e-10 ] [ 1.2684416e-10 2.3282064e-10 2.6076766e-10 ] [ 1.5476245e-10 2.7053143e-10 4.905367300000001e-10 ] [ 3.5359899e-10 2.7557872e-10 1.5616933e-10 ] [ 3.1930563e-10 9.477589e-11 5.6941904e-10 ] [ 4.5051971e-10 1.4640726e-10 3.5529728e-10 ] [ 3.9785349e-10 3.3535737e-10 5.203875100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 1.7e-05 -1.48e-05 ] [ -1.2e-06 -7e-06 2.2e-05 ] [ -1.2e-05 9e-07 -2.09e-05 ] [ -5.7e-06 -1.48e-05 -9.5e-06 ] [ 1.21e-05 2.44e-05 -1.13e-05 ] [ 3.7e-06 -1.73e-05 5.1e-06 ] [ 2.4e-06 -3.3e-06 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1215236438e-15 2.723700277799999e-14 -2.37122141832e-14 ] [ -1.9226119608e-15 -1.1215236438e-14 3.5247885948e-14 ] [ -1.9226119608e-14 1.4419589706e-15 -3.34854916506e-14 ] [ -9.1324068138e-15 -2.37122141832e-14 -1.5220678023e-14 ] [ 1.93863372714e-14 3.909310986959999e-14 -1.81045959642e-14 ] [ 5.9280535458e-15 -2.77176557682e-14 8.1711008334e-15 ] [ 3.845223921599999e-15 -5.2871828922e-15 4.710399303959999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.381594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.62462071344746e-18 } }