{ "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" [ [ 2.600247 1.761403 2.21582 ] [ 1.350999 3.710266 1.758192 ] [ 4.508932 5.134782 2.974852 ] [ 3.702352 3.46043 0.9070332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.600247e-10 1.761403e-10 2.21582e-10 ] [ 1.350999e-10 3.710266e-10 1.758192e-10 ] [ 4.508932e-10 5.134782e-10 2.974852e-10 ] [ 3.702352e-10 3.46043e-10 9.070332e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1607311 0.2852597 -0.2446974 ] [ 0.8916587 -0.1523448 -0.3636309 ] [ -0.1949414 -0.5213975 -0.6924353 ] [ -0.8574484 0.3884826 1.3007635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.575196106554669e-10 4.570364221964218e-10 -3.92048453450546e-10 ] [ 1.428594722872921e-09 -2.440832768604518e-10 -5.826009265804627e-10 ] [ -3.123305535060211e-10 -8.35370884643568e-10 -1.109403649076634e-09 ] [ -1.373783780022367e-09 6.224177393075981e-10 2.084052868889981e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5072381 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.202792137059901e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6288066 1.7595666 2.2067984 ] [ 1.2580137 3.5843632 1.5982786 ] [ 4.6734997 5.0256971 2.810441 ] [ 3.60221 3.6972541 1.2403792 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6288066e-10 1.7595666e-10 2.2067984e-10 ] [ 1.2580137e-10 3.5843632e-10 1.5982786e-10 ] [ 4.6734997e-10 5.0256971e-10 2.810441e-10 ] [ 3.60221e-10 3.6972541e-10 1.2403792e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.83e-05 5.66e-05 -4e-07 ] [ 0.0 -6.98e-05 -1.99e-05 ] [ 2.15e-05 -4.16e-05 -2.9e-05 ] [ -3.2e-06 5.48e-05 4.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.931983216064e-14 9.068319673728001e-14 -6.408706483200001e-16 ] [ 0.0 -1.1183192813184e-13 -3.188331475392e-14 ] [ 3.44467973472e-14 -6.665054742528e-14 -4.64631220032e-14 ] [ -5.126965186560001e-15 8.779927881984e-14 7.898730740544e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.1539594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.46662597384324e-18 } }