{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4059666 -2.2989018 1.4401494 ] [ -1.3584739 0.6193522 1.7616619 ] [ -3.2124622 2.142862 -2.6864927 ] [ 0.5240245 2.0301626 -1.1240535 ] [ 2.2439753 -1.0016806 1.1983012 ] [ -0.453275 -2.2932474 2.0289597 ] [ -0.1497553 0.801453 -2.618526 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.854783436945666e-09 -3.683246717475037e-09 2.307373699139147e-09 ] [ -2.176515122546997e-09 9.923116148810458e-10 2.822493509934108e-09 ] [ -5.146931832043734e-09 3.43324339800073e-09 -4.304235795889868e-09 ] [ 8.395798026264096e-10 3.252679054142542e-09 -1.800932238228413e-09 ] [ 3.595244763312666e-09 -1.604869238828917e-09 1.919890167316585e-09 ] [ -7.262266077931199e-10 -3.674187369990385e-09 3.250751795885382e-09 ] [ -2.399344405008903e-10 1.284069259270022e-09 -4.195341138156941e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.34499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.220932705320979e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7900551 2.8268494 3.2994016 ] [ 3.0420508 5.4228737 1.4133496 ] [ 0.9943898 4.1457104 1.4352831 ] [ 1.7612619 5.2400559 3.4506383 ] [ 3.0717896 2.930324 1.257135 ] [ 5.1109803 4.204071 1.2879735 ] [ 3.8638714 4.0606486 3.3387718 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7900551e-10 2.8268494e-10 3.2994016e-10 ] [ 3.0420508e-10 5.422873700000001e-10 1.4133496e-10 ] [ 9.943898e-11 4.1457104e-10 1.4352831e-10 ] [ 1.7612619e-10 5.2400559e-10 3.4506383e-10 ] [ 3.0717896e-10 2.930324e-10 1.257135e-10 ] [ 5.110980299999999e-10 4.204071e-10 1.2879735e-10 ] [ 3.8638714e-10 4.0606486e-10 3.3387718e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 -9.5e-06 -2.6e-06 ] [ 2.15e-05 1.88e-05 8.2e-06 ] [ 3.4e-06 -6.9e-06 -4.61e-05 ] [ 1.78e-05 1.32e-05 4.64e-05 ] [ 2.31e-05 -2.36e-05 2.52e-05 ] [ -3.78e-05 -2.6e-06 -2.42e-05 ] [ -3.41e-05 1.06e-05 -6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 -1.52206778976e-14 -4.16565921408e-15 ] [ 3.44467973472e-14 3.012092047104e-14 1.313784829056e-14 ] [ 5.44740051072e-15 -1.105501868352e-14 -7.386034221888001e-14 ] [ 2.851874385024e-14 2.114873139456e-14 7.434099520512001e-14 ] [ 3.701027994048e-14 -3.781136825088e-14 4.037485084416e-14 ] [ -6.056227626623999e-14 -4.16565921408e-15 -3.877267422336e-14 ] [ -5.463422276928e-14 1.698307218048e-14 -1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973336424062e-18 } }