{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3984881 2.0999648 -11.4355124 ] [ -5.8498265 -8.352902 1.4226459 ] [ -0.5625084 8.9506224 -1.4881549 ] [ 2.1057808 5.195546 14.9559364 ] [ 13.7050421 -7.8932313 -3.454915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.505803790468701e-08 3.364514507062948e-09 -1.83217106141485e-08 ] [ -9.372455254036292e-09 -1.338282430023356e-08 2.279330000656975e-09 ] [ -9.012378074836148e-10 1.434047795088879e-08 -2.384286988908962e-09 ] [ 3.37383276628952e-09 8.324182333490957e-09 2.396205164225172e-08 ] [ 2.195789803969974e-08 -1.264635065142679e-08 -5.535384039851233e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.0734407 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719841593355187e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7907898 3.096096 0.9454247 ] [ 1.7373889 1.0148569 1.497259 ] [ 1.9331791 4.7580158 2.1558366 ] [ 3.5858016 3.7038979 3.4557599 ] [ 3.4648846 1.3905115 3.0486351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.907898e-11 3.096096e-10 9.454247000000001e-11 ] [ 1.7373889e-10 1.0148569e-10 1.497259e-10 ] [ 1.9331791e-10 4.7580158e-10 2.1558366e-10 ] [ 3.5858016e-10 3.7038979e-10 3.4557599e-10 ] [ 3.4648846e-10 1.3905115e-10 3.0486351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 3e-07 3.1e-06 ] [ 3.1e-06 1e-06 -7.2e-06 ] [ -4.4e-06 -4e-07 1.2e-06 ] [ 5.9e-06 -2.1e-06 -6.4e-06 ] [ -4.6e-06 1.2e-06 9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 4.8065298624e-16 4.96674752448e-15 ] [ 4.96674752448e-15 1.6021766208e-15 -1.153567166976e-14 ] [ -7.04957713152e-15 -6.408706483200001e-16 1.92261194496e-15 ] [ 9.45284206272e-15 -3.36457090368e-15 -1.025393037312e-14 ] [ -7.370012455680001e-15 1.92261194496e-15 1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }