{ "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" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.6745495 -20.6117386 -28.7367867 ] [ 17.8263999 -20.1165349 10.3310982 ] [ -4.4031311 -12.3462841 17.8442726 ] [ -7.8598865 28.5961942 6.0669147 ] [ 11.1111671 24.4783633 -5.5054987 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.671557359137638e-08 -3.302364597103587e-08 -4.604140818698197e-08 ] [ 2.856104138811993e-08 -3.223024217382552e-08 1.655224413959946e-08 ] [ -7.054593764858717e-09 -1.978092790174572e-08 2.858967661044643e-08 ] [ -1.259292649619204e-08 4.581615416856631e-08 9.72026897281112e-09 ] [ 1.780205230408954e-08 3.921866171782313e-08 -8.820781375657376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.63654974 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.019865119806775e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8556841 2.0588499 0.881518 ] [ 3.0448675 1.5045728 2.4553594 ] [ 0.7476839 1.8820648 3.6263023 ] [ 0.5790904 4.2422688 2.534661 ] [ 2.8762859 3.8647847 1.3637384 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.556841e-11 2.0588499e-10 8.81518e-11 ] [ 3.0448675e-10 1.5045728e-10 2.4553594e-10 ] [ 7.476838999999999e-11 1.8820648e-10 3.6263023e-10 ] [ 5.790904000000001e-11 4.2422688e-10 2.534661e-10 ] [ 2.8762859e-10 3.8647847e-10 1.3637384e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 -5.8e-06 -6.9e-06 ] [ 2.3e-06 -1.5e-06 3.4e-06 ] [ -5e-07 5.5e-06 -5.3e-06 ] [ 3e-07 4.8e-06 1.12e-05 ] [ -5.9e-06 -2.9e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.9280535458e-15 -9.2926244772e-15 -1.10550187746e-14 ] [ 3.685006258199999e-15 -2.403264951e-15 5.4474005556e-15 ] [ -8.010883169999999e-16 8.811971486999999e-15 -8.4915361602e-15 ] [ 4.806529901999999e-16 7.690447843199998e-15 1.79443783008e-14 ] [ -9.452842140600001e-15 -4.6463122386e-15 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.98496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561072940742464e-18 } }