{ "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" [ [ 1.202318 1.231726 2.757655 ] [ 0.8396636 2.003193 0.0963359 ] [ 2.588342 1.167443 0.9025235 ] [ 2.880528 2.949579 2.371797 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.202318e-10 1.231726e-10 2.757655e-10 ] [ 8.396636e-11 2.003193e-10 9.633590000000001e-12 ] [ 2.588342e-10 1.167443e-10 9.025235000000001e-11 ] [ 2.880528e-10 2.949579e-10 2.371797e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5565437 -1.2784764 2.7784438 ] [ -2.8342177 0.6361045 -3.356696 ] [ 2.2592076 -1.651733 -1.1684485 ] [ 2.1315538 2.2941049 1.7467007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.493857925393529e-09 -2.048344998324549e-09 4.451557698566711e-09 ] [ -4.540917337197548e-09 1.019151758285673e-09 -5.378019854332877e-09 ] [ 3.619649598253678e-09 -2.646367996403846e-09 -1.872060869308829e-09 ] [ 3.415125664337399e-09 3.675561236442722e-09 2.798523025074994e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8183316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.252634810318186e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6939416 1.9695462 2.7582681 ] [ 0.6781326 1.3207877 0.429494 ] [ 3.0614807 1.7064298 0.3058816 ] [ 3.0772966 2.3551773 2.6346676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.939416e-11 1.9695462e-10 2.7582681e-10 ] [ 6.781326e-11 1.3207877e-10 4.29494e-11 ] [ 3.0614807e-10 1.7064298e-10 3.058816e-11 ] [ 3.0772966e-10 2.3551773e-10 2.6346676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.07e-05 1.27e-05 3.17e-05 ] [ 2.27e-05 5.2e-06 -1.35e-05 ] [ 1e-07 1.12e-05 5.84e-05 ] [ -7.35e-05 -2.92e-05 -7.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.123035467456e-14 2.034764308416e-14 5.078899887936e-14 ] [ 3.636940929216e-14 8.33131842816e-15 -2.16293843808e-14 ] [ 1.6021766208e-16 1.794437815296e-14 9.356711465472001e-14 ] [ -1.177599816288e-13 -4.678355732736e-14 -1.2272672915328e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }