{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0319931 -0.0321923 0.7467764 ] [ 3.9188226 -20.8884501 7.548089 ] [ -5.2351682 20.4008033 -6.9037798 ] [ -24.1288285 -46.0910501 -49.9340446 ] [ 26.0642128 40.6716876 49.3740065 ] [ -1.6510319 5.9392016 -0.8310475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.653435217646916e-09 -5.157775042977984e-11 1.196467689045189e-09 ] [ 6.27864595078267e-09 -3.346698639496743e-08 1.209337172751765e-08 ] [ -8.38766409599562e-09 3.268569009279949e-08 -1.10610745907113e-08 ] [ -3.865864490999274e-08 -7.38460028983415e-08 -8.000315884010449e-08 ] [ 4.175947238771611e-08 6.516322700120125e-08 7.910587888952723e-08 ] [ -2.645244710375004e-09 9.515649949737953e-09 -1.331484875274288e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.2995069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.888569436148284e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3534936 0.8316443 0.3081271 ] [ 0.7012419 0.8399998 3.7238894 ] [ 0.0613595 2.3175999 2.0377938 ] [ 2.3335237 -0.150693 0.8703664 ] [ 2.8526944 0.9327598 2.8304035 ] [ 2.2703883 3.0619643 2.0800186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.534936e-11 8.316443e-11 3.081271e-11 ] [ 7.012419e-11 8.399998e-11 3.7238894e-10 ] [ 6.13595e-12 2.3175999e-10 2.0377938e-10 ] [ 2.3335237e-10 -1.50693e-11 8.703664e-11 ] [ 2.8526944e-10 9.327598e-11 2.8304035e-10 ] [ 2.2703883e-10 3.0619643e-10 2.0800186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -1e-06 1.8e-06 ] [ -7e-07 -8e-07 -4e-07 ] [ 4e-07 9e-07 1e-07 ] [ 1.4e-06 -2e-07 -1e-06 ] [ -1.8e-06 4e-07 -5e-07 ] [ 1.1e-06 7e-07 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 -1.6021766208e-15 2.88391791744e-15 ] [ -1.12152363456e-15 -1.28174129664e-15 -6.408706483200001e-16 ] [ 6.408706483200001e-16 1.44195895872e-15 1.6021766208e-16 ] [ 2.24304726912e-15 -3.2043532416e-16 -1.6021766208e-15 ] [ -2.88391791744e-15 6.408706483200001e-16 -8.010883104e-16 ] [ 1.76239428288e-15 1.12152363456e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -18.486326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961835932168718e-18 } }