{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0267811e-10 1.1938958e-10 1.3459634e-10 ] [ 2.2320457e-10 2.0916766e-10 3.7542759e-10 ] [ 1.0249565e-10 3.4610968e-10 1.8890626e-10 ] [ 4.3151357e-10 2.0017535e-10 1.5979406e-10 ] [ 4.6908705e-10 1.9541647e-10 4.0350644e-10 ] [ 3.3892862e-10 4.1752012e-10 2.4959672e-10 ] [ 5.0264324e-10 4.3213284e-10 4.2898269e-10 ] ] "source-value" [ [ 2.0267811 1.1938958 1.3459634 ] [ 2.2320457 2.0916766 3.7542759 ] [ 1.0249565 3.4610968 1.8890626 ] [ 4.3151357 2.0017535 1.5979406 ] [ 4.6908705 1.9541647 4.0350644 ] [ 3.3892862 4.1752012 2.4959672 ] [ 5.0264324 4.3213284 4.2898269 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.263204113137344e-11 1.331440815417216e-11 2.64054728874048e-12 ] [ 1.41199825591104e-12 1.63918690074048e-12 -8.00175069726144e-12 ] [ -4.798518979296e-12 9.54640917737472e-12 1.687204134065856e-11 ] [ 1.5228688780704e-12 -1.465879455668544e-11 -6.55754869127232e-12 ] [ 1.510307813363328e-11 -3.80100381518592e-11 1.942655174486208e-11 ] [ -2.401246188657792e-11 9.01833176315904e-12 -3.886784351463552e-11 ] [ -1.85916575077632e-12 1.915065693076032e-11 1.448800252890816e-11 ] ] "source-value" [ [ 0.0078843 0.0083102 0.0016481 ] [ 0.0008813 0.0010231 -0.0049943 ] [ -0.002995 0.0059584 0.0105307 ] [ 0.0009505 -0.0091493 -0.0040929 ] [ 0.0094266 -0.023724 0.0121251 ] [ -0.0149874 0.0056288 -0.0242594 ] [ -0.0011604 0.0119529 0.0090427 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.754560740559201e-18 "source-value" -17.192616 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.073733428529683e-10 -3.486519776083882e-09 -6.937322228760269e-10 ] [ -7.855028809729087e-09 -5.154236315475623e-09 5.44583294111421e-09 ] [ -2.449598917767564e-09 2.306009605964198e-09 -1.704592236496075e-09 ] [ 2.599813550333261e-09 -9.48276110893682e-10 -1.622831064685277e-08 ] [ 2.447888594224859e-09 -1.298388071947774e-08 1.176627279057408e-08 ] [ -4.057950968134775e-09 1.249697555941039e-08 -5.992634032191206e-09 ] [ 1.022224989392627e-08 7.769927756556336e-09 7.407163406727786e-09 ] ] "source-value" [ [ -0.5663379 -2.1761145 -0.4329936 ] [ -4.9027234 -3.2170213 3.3990216 ] [ -1.5289194 1.439298 -1.0639228 ] [ 1.622676 -0.5918674 -10.1289149 ] [ 1.5278519 -8.103901 7.3439299 ] [ -2.5327738 7.7999987 -3.740308 ] [ 6.3802266 4.8496075 4.6231878 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.791303477172729e-18 "source-value" -11.180437 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] "source-value" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] } "instance-id" 1 }