{ "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" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0934786 -7.1144908 4.033783 ] [ 0.493236 0.3050097 -0.2225442 ] [ -17.0499239 0.5209986 0.2257479 ] [ 6.8684586 -24.9442422 -11.5369988 ] [ 10.680515 13.7881079 -12.0135476 ] [ 2.101193 17.4446166 19.5135597 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.956299130699032e-09 -1.139867092256796e-08 6.462832869226421e-09 ] [ 7.902511942476239e-10 4.886794144833497e-10 -3.565551172722228e-10 ] [ -2.731698968405815e-08 8.347317832667123e-10 3.616880105545686e-10 ] [ 1.100448388051635e-08 -3.996508200567676e-08 -1.848430990384604e-08 ] [ 1.711207157208651e-08 2.20909843044508e-08 -1.924782525616678e-08 ] [ 3.366482328124361e-09 2.794935710560852e-08 3.126416939750404e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4744839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.168913553789192e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.1222623 1.9510903 5.2857588 ] [ 1.4085204 1.8341205 3.4125603 ] [ 1.5117599 4.2951153 3.164438 ] [ 3.8881911 1.6762014 2.8780164 ] [ 3.9914287 4.1371966 2.629887 ] [ 3.2255053 4.412085 5.0376294 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1222623e-10 1.9510903e-10 5.2857588e-10 ] [ 1.4085204e-10 1.8341205e-10 3.4125603e-10 ] [ 1.5117599e-10 4.2951153e-10 3.164438e-10 ] [ 3.8881911e-10 1.6762014e-10 2.8780164e-10 ] [ 3.9914287e-10 4.1371966e-10 2.629887e-10 ] [ 3.2255053e-10 4.412085000000001e-10 5.0376294e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.01e-05 -7e-07 -7e-07 ] [ 4.6e-06 -1.02e-05 2.45e-05 ] [ -1.34e-05 9.1e-06 -1e-07 ] [ 1.26e-05 -7e-06 -2.68e-05 ] [ 3.12e-05 -2.9e-06 -3.59e-05 ] [ -1.48e-05 1.18e-05 3.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.22037503434e-14 -1.1215236438e-15 -1.1215236438e-15 ] [ 7.370012516399999e-15 -1.63422016668e-14 3.925332753299999e-14 ] [ -2.14691668956e-14 1.45798073694e-14 -1.602176634e-16 ] [ 2.01874255884e-14 -1.1215236438e-14 -4.293833379119999e-14 ] [ 4.998791098079999e-14 -4.6463122386e-15 -5.751814116059999e-14 ] [ -2.37122141832e-14 1.89056842812e-14 6.248488872599999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471900460881e-18 } }