{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5162765 5.0812924 -0.2427721 ] [ 6.1836177 -3.5340866 -2.1433667 ] [ -0.5335766 -1.67557 -0.2066846 ] [ -5.0045371 -9.0543159 3.605098 ] [ 6.9183125 -0.9353918 2.5943101 ] [ 4.0852764 7.1116508 0.0113114 ] [ -5.1328164 3.0064211 -3.6178962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.044022586296845e-08 8.141127886728722e-09 -3.889637828025197e-10 ] [ 9.907247710905068e-09 -5.662230926402562e-09 -3.434052016541247e-09 ] [ -8.548839539259532e-10 -2.684559080513856e-09 -3.311452339993997e-10 ] [ -8.018152339546231e-09 -1.450661325231771e-08 5.776003731292838e-09 ] [ 1.10843585428884e-08 -1.49866287324803e-09 4.15654298932531e-09 ] [ 6.545334337585989e-09 1.139412064705362e-08 1.812286062851712e-11 ] [ -8.223678434938822e-09 4.816817598699818e-09 -5.796508708121161e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.763375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.88470044067032e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1586887 3.640255 2.7018069 ] [ 5.2228992 2.0981817 1.1468301 ] [ 3.462906 0.3113474 1.3534524 ] [ 3.1141969 1.5062062 3.551434 ] [ 5.5529907 2.157879 3.6409302 ] [ 5.1149803 5.9082633 1.5862218 ] [ 3.7927432 4.0404878 0.8856117 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1586887e-10 3.640255e-10 2.7018069e-10 ] [ 5.2228992e-10 2.0981817e-10 1.1468301e-10 ] [ 3.462906e-10 3.113474e-11 1.3534524e-10 ] [ 3.1141969e-10 1.5062062e-10 3.551434e-10 ] [ 5.5529907e-10 2.157879e-10 3.6409302e-10 ] [ 5.114980300000001e-10 5.9082633e-10 1.5862218e-10 ] [ 3.7927432e-10 4.0404878e-10 8.856117e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 -1.03e-05 2.9e-06 ] [ -1e-06 6.3e-06 -8.9e-06 ] [ -7.2e-06 -1.84e-05 2.16e-05 ] [ 9.4e-06 -6.1e-06 -1.54e-05 ] [ -2.29e-05 0.0 1.5e-06 ] [ 1.82e-05 3.1e-05 4.3e-06 ] [ -9.2e-06 -2.4e-06 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.034764308416e-14 -1.650241919424e-14 4.646312200320001e-15 ] [ -1.6021766208e-15 1.009371271104e-14 -1.425937192512e-14 ] [ -1.153567166976e-14 -2.948004982272e-14 3.460701500928e-14 ] [ 1.506046023552e-14 -9.77327738688e-15 -2.467351996032e-14 ] [ -3.668984461632e-14 0.0 2.4032649312e-15 ] [ 2.915961449856e-14 4.96674752448e-14 6.889359469440001e-15 ] [ -1.474002491136e-14 -3.84522388992e-15 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.528281 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.288993188341284e-18 } }