{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2195346 -2.4123211 6.1264226 ] [ 0.0614264 1.6172427 -0.169768 ] [ -4.0718786 1.7853914 -5.2168139 ] [ 6.6724758 -4.7253294 -3.6555745 ] [ 1.9504044 -1.8002233 4.0250626 ] [ 0.5959109 3.075402 -4.2904421 ] [ 3.0111957 2.4598378 3.1811133 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.316914627847453e-08 -3.864964500125178e-09 9.815611139729526e-09 ] [ 9.841594279073759e-11 2.591108465447072e-09 -2.719983228009119e-10 ] [ -6.523868749404632e-09 2.860512383624547e-09 -8.358257334506412e-09 ] [ 1.069048481769046e-08 -7.570812352633238e-09 -5.856876047746232e-09 ] [ 3.124892356530789e-09 -2.884275707242372e-09 6.448861248107288e-09 ] [ 9.547545199259106e-10 4.927337224556867e-09 -6.874046082149891e-09 ] [ 4.824467390941273e-09 3.941094646589964e-09 5.096705399366632e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3838356 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.503456213561737e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4819402 2.6521477 4.2675578 ] [ 2.5593629 4.9694231 2.263158 ] [ 2.3399449 2.5120052 1.756869 ] [ 4.7887441 2.3363304 1.6483647 ] [ 4.9045479 2.2195136 4.1222563 ] [ 4.9906044 4.7951825 1.8943287 ] [ 5.7087746 4.5740455 4.2708805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4819402e-10 2.6521477e-10 4.2675578e-10 ] [ 2.5593629e-10 4.9694231e-10 2.263158e-10 ] [ 2.3399449e-10 2.5120052e-10 1.756869e-10 ] [ 4.7887441e-10 2.3363304e-10 1.6483647e-10 ] [ 4.9045479e-10 2.2195136e-10 4.1222563e-10 ] [ 4.9906044e-10 4.795182500000001e-10 1.8943287e-10 ] [ 5.708774600000001e-10 4.5740455e-10 4.2708805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 -5.7e-06 1.9e-06 ] [ 4e-07 -3.3e-06 -2.64e-05 ] [ -7.9e-06 8.5e-06 1.4e-05 ] [ -1.6e-06 1.53e-05 1.3e-06 ] [ 1.03e-05 -7.8e-06 -2.7e-06 ] [ -1e-05 -4e-06 -2.02e-05 ] [ 9.7e-06 -3e-06 3.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-15 -9.1324068138e-15 3.0441356046e-15 ] [ 6.408706536e-16 -5.2871828922e-15 -4.22974631376e-14 ] [ -1.26571954086e-14 1.3618501389e-14 2.243047287599999e-14 ] [ -2.5634826144e-15 2.45133025002e-14 2.0828296242e-15 ] [ 1.65024193302e-14 -1.24969777452e-14 -4.3258769118e-15 ] [ -1.602176634e-14 -6.408706535999999e-15 -3.236396800679999e-14 ] [ 1.55411133498e-14 -4.806529901999999e-15 5.14298699514e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.800352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.012148468537517e-18 } }