{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2979571 0.5443231 0.226357 ] [ -4.3638094 0.8383579 3.5908478 ] [ 0.9043363 -1.6466382 -0.1832753 ] [ 0.6638642 -1.7163327 4.5251315 ] [ 4.093566 1.98029 -8.159061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.079556520421368e-09 8.721017449813804e-10 3.626638933544257e-10 ] [ -6.991593398307276e-09 1.343197427242984e-09 5.753172394011115e-09 ] [ 1.448906477200775e-09 -2.638205226956195e-09 -2.936394008301062e-10 ] [ 1.063627700626095e-09 -2.74986812545454e-09 7.250059895345635e-09 ] [ 6.558615740901774e-09 3.172774340404033e-09 -1.307225678188107e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.003786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.763000866948635e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4246816 1.4613404 3.1062298 ] [ 1.590396 3.8814744 3.1359636 ] [ 3.4822436 1.3361718 1.8271065 ] [ 3.4786909 2.5255742 4.0055469 ] [ 3.6479539 3.7563051 1.8568353 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4246816e-10 1.4613404e-10 3.1062298e-10 ] [ 1.590396e-10 3.8814744e-10 3.135963600000001e-10 ] [ 3.4822436e-10 1.3361718e-10 1.8271065e-10 ] [ 3.4786909e-10 2.5255742e-10 4.0055469e-10 ] [ 3.6479539e-10 3.7563051e-10 1.8568353e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8e-06 2.6e-06 1.07e-05 ] [ -3.32e-05 1.35e-05 5.3e-06 ] [ 1.34e-05 -2.34e-05 -3.08e-05 ] [ 8.4e-06 -3.7e-06 3.03e-05 ] [ 1.92e-05 1.09e-05 -1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249697764224e-14 4.16565921408e-15 1.714328984256e-14 ] [ -5.319226381056e-14 2.16293843808e-14 8.491536090240001e-15 ] [ 2.146916671872e-14 -3.749093292672001e-14 -4.934703992064001e-14 ] [ 1.345828361472e-14 -5.928053496960001e-15 4.854595161024e-14 ] [ 3.076179111936e-14 1.746372516672e-14 -2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888444012729e-18 } }