{ "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" [ [ 1.79141 2.530899 1.169625 ] [ 2.427567 4.27143 3.28825 ] [ 4.049049 2.026656 0.8582536 ] [ 3.63347 2.471275 3.089518 ] [ 3.6938 4.301317 1.502863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.79141e-10 2.530899e-10 1.169625e-10 ] [ 2.427567e-10 4.27143e-10 3.28825e-10 ] [ 4.049049e-10 2.026656e-10 8.582536e-11 ] [ 3.63347e-10 2.471275e-10 3.089518e-10 ] [ 3.6938e-10 4.301317e-10 1.502863e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7489708 0.4218883 0.200537 ] [ -3.3719127 2.1479513 2.001376 ] [ 0.8027201 -0.8449868 -1.2960398 ] [ 1.7586864 -3.3974027 2.0134434 ] [ 1.559477 1.6725498 -2.9193167 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.199983505421873e-09 6.759395708490566e-10 3.212956930053696e-10 ] [ -5.402399695318605e-09 3.441397355476967e-09 3.206557836630221e-09 ] [ 1.286099377266238e-09 -1.353818095844605e-09 -2.076484667186308e-09 ] [ 2.817726233398917e-09 -5.443239177382796e-09 3.225891942784062e-09 ] [ 2.498557590075322e-09 2.679720186683716e-09 -4.677260965451008e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.131515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943682970788452e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7120462 2.9277459 1.0715296 ] [ 2.4191345 3.9496826 3.1337611 ] [ 3.9716153 2.0979572 1.1255962 ] [ 3.8875013 2.1486681 3.4717269 ] [ 3.6049987 4.4775233 1.1058958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7120462e-10 2.9277459e-10 1.0715296e-10 ] [ 2.4191345e-10 3.9496826e-10 3.1337611e-10 ] [ 3.9716153e-10 2.0979572e-10 1.1255962e-10 ] [ 3.8875013e-10 2.1486681e-10 3.4717269e-10 ] [ 3.6049987e-10 4.4775233e-10 1.1058958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 4.7e-06 2.3e-06 ] [ -3.9e-06 3.2e-06 -8.4e-06 ] [ -2.3e-06 8.2e-06 -4.1e-06 ] [ 5.9e-06 -4.8e-06 6.7e-06 ] [ -2.7e-06 -1.13e-05 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-15 7.53023011776e-15 3.68500622784e-15 ] [ -6.24848882112e-15 5.126965186560001e-15 -1.345828361472e-14 ] [ -3.68500622784e-15 1.313784829056e-14 -6.568924145279999e-15 ] [ 9.45284206272e-15 -7.69044777984e-15 1.073458335936e-14 ] [ -4.32587687616e-15 -1.810459581504e-14 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }