{ "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" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.0242917 3.0608781 3.1117172 ] [ -3.0118516 -4.7730925 -6.0958058 ] [ -5.0468376 2.4531469 -14.3659885 ] [ 2.4386912 -3.2452285 15.9029307 ] [ -2.4042937 2.504296 1.4471464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.285633256021949e-08 4.904067330938725e-09 4.985520548381238e-09 ] [ -4.825518218839074e-09 -7.647337212415824e-09 -9.766557537697041e-09 ] [ -8.085925211694383e-09 3.930374610567996e-09 -2.301685090938166e-08 ] [ 3.907214025990698e-09 -5.199429231853853e-09 2.547930376974258e-08 ] [ -3.852103155676729e-09 4.012324502762957e-09 2.318584128954885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4801954 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.038241756809571e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7759348 2.4307104 3.0157442 ] [ 0.0330068 1.8029578 1.3286749 ] [ 2.2450743 0.6452435 1.1175814 ] [ 3.1828612 0.4708441 3.3601926 ] [ 1.9963105 3.0856995 0.6073168 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7759348e-10 2.4307104e-10 3.0157442e-10 ] [ 3.30068e-12 1.8029578e-10 1.3286749e-10 ] [ 2.2450743e-10 6.452435e-11 1.1175814e-10 ] [ 3.1828612e-10 4.708441e-11 3.3601926e-10 ] [ 1.9963105e-10 3.0856995e-10 6.073168000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 1.7e-05 1.6e-06 ] [ 4.2e-06 -4e-07 -2.75e-05 ] [ -3.31e-05 -5.7e-06 -5.6e-06 ] [ 3.72e-05 -1.05e-05 1.5e-05 ] [ -6e-07 -3e-07 1.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 2.72370025536e-14 2.56348259328e-15 ] [ 6.72914180736e-15 -6.408706483200001e-16 -4.4059857072e-14 ] [ -5.303204614848e-14 -9.13240673856e-15 -8.972189076479999e-15 ] [ 5.960097029376001e-14 -1.68228545184e-14 2.4032649312e-14 ] [ -9.6130597248e-16 -4.8065298624e-16 2.64359142432e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.797586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.370834633347739e-18 } }