{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9021754 -0.4455027 -0.612582 ] [ -2.8999272 -0.5745746 1.9413752 ] [ -0.6628065 -0.1395405 0.4504485 ] [ 0.1492332 0.7067378 -0.6269652 ] [ 4.1017306 -2.4882545 -2.1450268 ] [ -0.0460784 3.2066272 1.5794986 ] [ 0.2600238 -0.2654927 -0.5867483 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.445444333740888e-09 -7.137740104432761e-10 -9.814645587229056e-10 ] [ -4.646195561862007e-09 -9.205699910255118e-10 3.110425957640925e-09 ] [ -1.061933078414275e-09 -2.235685267547424e-10 7.216980555744288e-10 ] [ 2.390979440871706e-10 1.132318780195626e-09 -1.004508985495196e-09 ] [ 6.571696872139957e-09 -3.986623186500394e-09 -3.436711789949437e-09 ] [ -7.382573520387071e-11 5.137583131461365e-09 2.530635729506331e-09 ] [ 4.166040532115751e-10 -4.253661969330682e-10 -9.400744085541448e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.590514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.298964014105509e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.911909 2.5941111 2.8416661 ] [ 2.5724772 0.8914357 5.6496836 ] [ 2.0521265 0.2262617 3.3897313 ] [ 3.7560364 1.195382 1.825137 ] [ 4.442757 0.6472777 4.0955439 ] [ 3.5607853 2.8974259 4.6769735 ] [ 4.1310155 3.5115082 2.3868576 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.911909e-10 2.5941111e-10 2.8416661e-10 ] [ 2.5724772e-10 8.914357000000001e-11 5.649683600000001e-10 ] [ 2.0521265e-10 2.262617e-11 3.3897313e-10 ] [ 3.7560364e-10 1.195382e-10 1.825137e-10 ] [ 4.442757000000001e-10 6.472777e-11 4.0955439e-10 ] [ 3.5607853e-10 2.8974259e-10 4.6769735e-10 ] [ 4.1310155e-10 3.511508200000001e-10 2.3868576e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.21e-05 -1.98e-05 7.9e-06 ] [ -5e-07 6.7e-06 2.93e-05 ] [ -1.35e-05 4.5e-06 1.62e-05 ] [ -7e-06 -2.81e-05 -3.13e-05 ] [ 1.04e-05 7.5e-06 -3.2e-05 ] [ -5.04e-05 -9.9e-06 6.4e-06 ] [ 3.89e-05 3.92e-05 3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.540810331968e-14 -3.172309709184e-14 1.265719530432e-14 ] [ -8.010883104e-16 1.073458335936e-14 4.694377498944e-14 ] [ -2.16293843808e-14 7.2097947936e-15 2.595526125696e-14 ] [ -1.12152363456e-14 -4.502116304448e-14 -5.014812823104e-14 ] [ 1.666263685632e-14 1.2016324656e-14 -5.12696518656e-14 ] [ -8.074970168832e-14 -1.586154854592e-14 1.025393037312e-14 ] [ 6.232467054911999e-14 6.280532353535999e-14 5.6076181728e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.501501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.444920221430782e-18 } }