{ "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" [ [ 1.382185 0.3943114 1.075216 ] [ 0.9807846 1.486461 2.753824 ] [ 0.491957 1.894504 0.6685531 ] [ 1.794418 2.681383 2.23804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.382185e-10 3.943114e-11 1.075216e-10 ] [ 9.807846e-11 1.486461e-10 2.753824e-10 ] [ 4.91957e-11 1.894504e-10 6.685531000000001e-11 ] [ 1.794418e-10 2.681383e-10 2.23804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 11.6048529 -26.1640966 -3.1464808 ] [ -25.3850236 -35.3064163 30.1114753 ] [ -15.8813223 17.8304847 -16.5383498 ] [ 29.661493 43.6400282 -10.4266447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.859302400420308e-08 -4.191950387687277e-08 -5.04121797555608e-09 ] [ -4.067129133037625e-08 -5.656711476009204e-08 4.824390174345667e-08 ] [ -2.544468329644969e-08 2.85675857238721e-08 -2.649735739617235e-08 ] [ 4.752295062262286e-08 6.991903291309272e-08 -1.670532637172823e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.733743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.520823519227566e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9103724 0.0465495 1.1256695 ] [ 1.4123963 1.0203093 3.2386745 ] [ 0.9122833 2.2080195 0.129141 ] [ 1.4142926 3.181781 2.2421481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.103724e-11 4.65495e-12 1.1256695e-10 ] [ 1.4123963e-10 1.0203093e-10 3.2386745e-10 ] [ 9.122833000000001e-11 2.2080195e-10 1.29141e-11 ] [ 1.4142926e-10 3.181781e-10 2.2421481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 6e-07 4e-07 ] [ -4.6e-06 1.4e-06 7.1e-06 ] [ -7.9e-06 3.2e-06 -1.07e-05 ] [ 6.3e-06 -5.2e-06 3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 9.6130597248e-16 6.408706483200001e-16 ] [ -7.370012455680001e-15 2.24304726912e-15 1.137545400768e-14 ] [ -1.265719530432e-14 5.126965186560001e-15 -1.714328984256e-14 ] [ 1.009371271104e-14 -8.33131842816e-15 5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956239714319e-18 } }