{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7750433 -1.5188168 -1.8339337 ] [ 0.8525801 -2.2400849 0.1505098 ] [ -1.6487995 2.5093285 -0.8431005 ] [ -0.4101948 -0.5444401 0.929694 ] [ 0.0275958 0.9080621 0.1913168 ] [ 1.3492131 -0.0992769 -1.2851017 ] [ 0.6046486 0.985228 2.6906153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.241756265598252e-09 -2.433412788286651e-09 -2.938285722445165e-09 ] [ 1.365983914833383e-09 -3.589011684956226e-09 2.411432847480132e-10 ] [ -2.641668033050883e-09 4.020387489730269e-09 -1.350795921213717e-09 ] [ -6.572045239483032e-10 -8.722892068326233e-10 1.489534003569996e-09 ] [ 4.421334595653719e-11 1.454875878840971e-09 3.065233066516512e-10 ] [ 2.161677703106705e-09 -1.590591294759546e-10 -2.058959916053677e-09 ] [ 9.687538587008124e-10 1.578509280762552e-09 4.3108409647429e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.956761005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.876990290575989e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.877662 2.7380964 2.6417456 ] [ 4.6002605 1.3619528 1.7920133 ] [ 3.3632173 3.0918402 0.9277736 ] [ 3.7620163 2.0159224 3.9479996 ] [ 5.8097921 2.9469724 3.1003932 ] [ 4.5237968 4.6126757 2.1831406 ] [ 3.0871981 4.3231491 3.9500734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.877662e-10 2.7380964e-10 2.6417456e-10 ] [ 4.6002605e-10 1.3619528e-10 1.7920133e-10 ] [ 3.3632173e-10 3.0918402e-10 9.277736e-11 ] [ 3.7620163e-10 2.0159224e-10 3.947999600000001e-10 ] [ 5.8097921e-10 2.9469724e-10 3.1003932e-10 ] [ 4.523796800000001e-10 4.6126757e-10 2.1831406e-10 ] [ 3.0871981e-10 4.3231491e-10 3.9500734e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 -9e-06 -1.04e-05 ] [ 1.66e-05 -4.87e-05 4.3e-06 ] [ 2.84e-05 2.95e-05 1.28e-05 ] [ -8.7e-06 1.05e-05 1.72e-05 ] [ -2.6e-06 -1.24e-05 -3.52e-05 ] [ -5.8e-06 2.7e-05 -2.18e-05 ] [ -1.56e-05 3.1e-06 3.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.97067725982e-14 -1.4419589706e-14 -1.66626369936e-14 ] [ 2.65961321244e-14 -7.802600207579999e-14 6.8893595262e-15 ] [ 4.550181640559999e-14 4.726421070299999e-14 2.05078609152e-14 ] [ -1.39389367158e-14 1.6822854657e-14 2.75574381048e-14 ] [ -4.165659248399999e-15 -1.98669902616e-14 -5.63966175168e-14 ] [ -9.2926244772e-15 4.325876911799999e-14 -3.492745062119999e-14 ] [ -2.49939554904e-14 4.9667475654e-15 5.303204658539999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }