{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.225559 -0.7034876 -1.5880423 ] [ -0.17418 -3.3961172 6.2491032 ] [ -3.8677193 2.0232289 -3.3188583 ] [ 0.0429454 0.6504634 -5.5459687 ] [ 1.6232681 -0.7905344 2.1857231 ] [ 0.7701442 -0.4166554 0.4805791 ] [ 1.8311006 2.6331024 1.537464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.61385359388406e-10 -1.127111395028738e-09 -2.544324266863618e-09 ] [ -2.790671261101199e-10 -5.441179624165504e-09 1.001216713049463e-08 ] [ -6.196769489330835e-09 3.241570068813522e-09 -5.317397219816962e-09 ] [ 6.88061164177836e-11 1.042157260752195e-09 -8.885621464035354e-09 ] [ 2.600762220537575e-09 -1.266575744053209e-09 3.501914479214045e-09 ] [ 1.233907042050622e-09 -6.675555463099236e-10 7.699726048087493e-10 ] [ 2.93374659582338e-09 4.218695140209321e-09 2.463288896416176e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.669113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.311556989410564e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0323524 1.6969212 2.7133873 ] [ 3.0826984 2.0084701 4.8101749 ] [ 1.4296888 3.9587425 2.5473363 ] [ 4.1974136 2.0876933 1.8435501 ] [ 5.1491706 1.5713269 3.8811828 ] [ 3.7675495 4.3687028 2.1407356 ] [ 2.9146267 4.3080853 4.4106399 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0323524e-10 1.6969212e-10 2.7133873e-10 ] [ 3.0826984e-10 2.0084701e-10 4.8101749e-10 ] [ 1.4296888e-10 3.9587425e-10 2.5473363e-10 ] [ 4.1974136e-10 2.0876933e-10 1.8435501e-10 ] [ 5.149170599999999e-10 1.5713269e-10 3.8811828e-10 ] [ 3.7675495e-10 4.368702800000001e-10 2.1407356e-10 ] [ 2.9146267e-10 4.308085300000001e-10 4.4106399e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 -7.7e-06 -7e-07 ] [ 2.2e-06 -4.6e-06 8.5e-06 ] [ 1.25e-05 -8.1e-06 2.6e-06 ] [ 6e-07 -5e-07 -1.2e-05 ] [ -2.28e-05 4.8e-06 2e-07 ] [ -2.8e-06 7.7e-06 5e-07 ] [ 3.9e-06 8.4e-06 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.02539304576e-14 -1.23367600818e-14 -1.1215236438e-15 ] [ 3.5247885948e-15 -7.370012516399999e-15 1.3618501389e-14 ] [ 2.0027207925e-14 -1.29776307354e-14 4.165659248399999e-15 ] [ 9.613059803999998e-16 -8.010883169999999e-16 -1.9226119608e-14 ] [ -3.65296272552e-14 7.690447843199998e-15 3.204353268e-16 ] [ -4.486094575199999e-15 1.23367600818e-14 8.010883169999999e-16 ] [ 6.248488872599999e-15 1.34582837256e-14 1.602176634e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.583206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.61822849740086e-18 } }