{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2918.8407414 5574.9837917 -11639.7868698 ] [ 2915.7103279 -5587.8986484 11635.9449165 ] [ 8.2089634 13.0513498 4.8004693 ] [ -5.0785499 -0.1364931 -0.9585161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.676498395709618e-06 8.932108692400678e-06 -1.864899439388838e-05 ] [ 4.671482920386482e-06 -8.952800573866399e-06 1.864283890613291e-05 ] [ 1.315220924048288e-08 2.091056751944276e-08 7.691199681328141e-09 ] [ -8.136733917346178e-09 -2.186860537205165e-10 -1.535712086080395e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1386.0724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.220732794016146e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.4903651 0.8516674 -0.1015942 ] [ 0.6932573 0.5876392 2.0932971 ] [ 0.3897308 2.6155954 1.2425992 ] [ 2.3194086 1.5612629 0.9373932 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.903651e-11 8.516674e-11 -1.015942e-11 ] [ 6.932573e-11 5.876392e-11 2.0932971e-10 ] [ 3.897308e-11 2.6155954e-10 1.2425992e-10 ] [ 2.3194086e-10 1.5612629e-10 9.373932000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.77e-05 -2.3e-06 -7.4e-06 ] [ 1.12e-05 -1.66e-05 1.7e-06 ] [ -1.2e-06 1.23e-05 -1.58e-05 ] [ 1.77e-05 6.6e-06 2.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.438029239616e-14 -3.68500622784e-15 -1.185610699392e-14 ] [ 1.794437815296e-14 -2.659613190528e-14 2.72370025536e-15 ] [ -1.92261194496e-15 1.970677243584e-14 -2.531439060864e-14 ] [ 2.835852618816e-14 1.057436569728e-14 3.44467973472e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.027265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.048503914076612e-18 } }