{ "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" [ [ 2.464863 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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "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 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "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 ] ] } "unrelaxed-potential-energy" { "source-value" -11.180437 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.791303477172729e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0269844 1.2026329 1.342696 ] [ 2.2354205 2.0896425 3.7528067 ] [ 1.0201896 3.4663457 1.898717 ] [ 4.3205914 1.9927444 1.5986185 ] [ 4.6935215 1.9544997 4.0371837 ] [ 3.3919057 4.1679631 2.4868706 ] [ 5.0168949 4.3252886 4.2912086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0269844e-10 1.2026329e-10 1.342696e-10 ] [ 2.2354205e-10 2.0896425e-10 3.7528067e-10 ] [ 1.0201896e-10 3.4663457e-10 1.898717e-10 ] [ 4.3205914e-10 1.9927444e-10 1.5986185e-10 ] [ 4.6935215e-10 1.9544997e-10 4.0371837e-10 ] [ 3.391905700000001e-10 4.1679631e-10 2.4868706e-10 ] [ 5.0168949e-10 4.3252886e-10 4.2912086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0002167 0.0003106 -0.00012 ] [ 0.0010395 -0.0001259 -0.0014373 ] [ -1.82e-05 3.34e-05 0.0003583 ] [ -0.0007988 -7.23e-05 0.0014678 ] [ 0.0008502 -0.0007879 0.0008267 ] [ -0.0006936 0.0007803 -0.0010298 ] [ -0.0001624 -0.0001382 -6.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.4719167372736e-13 4.976360584204801e-13 -1.92261194496e-13 ] [ 1.6654625973216e-12 -2.0171403655872e-13 -2.30280845707584e-12 ] [ -2.915961449856e-14 5.351269913472e-14 5.7405988323264e-13 ] [ -1.27981868469504e-12 -1.1583736968384e-13 2.35167484401024e-12 ] [ 1.36217056300416e-12 -1.26235495952832e-12 1.32451941241536e-12 ] [ -1.11126970418688e-12 1.25017841721024e-12 -1.64992148409984e-12 ] [ -2.6019348321792e-13 -2.2142080899456e-13 -1.049425686624e-13 ] ] } "relaxed-potential-energy" { "source-value" -17.192906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.754607203681205e-18 } }