{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1493607 -0.1904282 0.2791851 ] [ -0.3283085 -0.0440025 -2.9617802 ] [ -3.2416497 -0.500581 1.4462354 ] [ 1.0211769 2.1937506 1.0960155 ] [ -0.7171337 -3.6331832 -3.3714704 ] [ 0.832418 1.8019481 -1.8481873 ] [ 2.2841364 0.3724962 5.360002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.393022216063226e-10 -3.050996099810265e-10 4.473038400957101e-10 ] [ -5.260082031099168e-10 -7.0499776756752e-11 -4.745294992388348e-09 ] [ -5.193695362163334e-09 -8.02019175016685e-10 2.317124546053337e-09 ] [ 1.636105754881019e-09 3.514775923185973e-09 1.756010410134422e-09 ] [ -1.148974848127801e-09 -5.821001182123331e-09 -5.401691052599224e-09 ] [ 1.333680658333095e-09 2.887039117714981e-09 -2.961122482919476e-09 ] [ 3.659589938798277e-09 5.96804702976841e-10 8.587669891841241e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.662286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.509374845748315e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4331913 1.9094438 3.576658 ] [ 2.202292 3.6421594 0.7837024 ] [ 1.4216495 3.8510447 2.9213262 ] [ 3.2226536 5.108287 3.5523839 ] [ 3.047289 1.5748408 1.3748042 ] [ 3.9141295 5.0872397 1.3481422 ] [ 4.1676382 3.1846817 4.4149451 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4331913e-10 1.9094438e-10 3.576658e-10 ] [ 2.202292e-10 3.6421594e-10 7.837024e-11 ] [ 1.4216495e-10 3.8510447e-10 2.9213262e-10 ] [ 3.2226536e-10 5.108287e-10 3.5523839e-10 ] [ 3.047289e-10 1.5748408e-10 1.3748042e-10 ] [ 3.9141295e-10 5.0872397e-10 1.3481422e-10 ] [ 4.1676382e-10 3.1846817e-10 4.4149451e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.51e-05 2.26e-05 5.21e-05 ] [ 2.58e-05 9.9e-06 -4.04e-05 ] [ -7.2e-06 2.02e-05 -3e-06 ] [ -4.8e-06 -3.78e-05 4.7e-06 ] [ -1.06e-05 -1.59e-05 -1.48e-05 ] [ -2.38e-05 6.4e-06 1.58e-05 ] [ -4.5e-06 -5.5e-06 -1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.021463318208e-14 3.620919163008e-14 8.347340194367999e-14 ] [ 4.133615681664e-14 1.586154854592e-14 -6.472793548032e-14 ] [ -1.153567166976e-14 3.236396774016e-14 -4.8065298624e-15 ] [ -7.69044777984e-15 -6.056227626623999e-14 7.53023011776e-15 ] [ -1.698307218048e-14 -2.547460827072e-14 -2.371221398784e-14 ] [ -3.813180357504e-14 1.025393037312e-14 2.531439060864e-14 ] [ -7.2097947936e-15 -8.8119714144e-15 -2.291112567744e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }