{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7709295 -0.3003752 2.8148445 ] [ -14.1902059 2.8858296 -7.9201681 ] [ -5.0455706 4.3465205 3.6884567 ] [ -1.5613413 -5.6215636 -0.1916349 ] [ 12.6121518 5.1399881 -18.2219423 ] [ 5.4140366 -6.4503994 19.8304441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.439518462785033e-09 -4.812541229081242e-10 4.509878049087465e-09 ] [ -2.273521613731823e-08 4.623608716732616e-09 -1.268950816262596e-08 ] [ -8.083895253915829e-09 6.963893526927925e-09 5.90955909157312e-09 ] [ -2.501544527949479e-09 -9.006737772260283e-09 -3.070329565093459e-10 ] [ 2.020689475194063e-08 8.235168765010212e-09 -2.919476993862658e-08 ] [ 8.674242864675522e-09 -1.033467911350235e-08 3.17718739171013e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3080081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.504366480837029e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8702871 0.2471406 0.2788219 ] [ -0.0404827 2.4847902 0.3423083 ] [ 0.0014294 3.2718633 2.5929416 ] [ 1.494151 -0.3955334 2.4888801 ] [ 2.1941073 2.1132561 -0.5040778 ] [ 1.7958844 1.8839675 1.8641448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.702871e-11 2.471406e-11 2.788219e-11 ] [ -4.04827e-12 2.4847902e-10 3.423083e-11 ] [ 1.4294e-13 3.2718633e-10 2.5929416e-10 ] [ 1.494151e-10 -3.955334e-11 2.4888801e-10 ] [ 2.1941073e-10 2.1132561e-10 -5.040778e-11 ] [ 1.7958844e-10 1.8839675e-10 1.8641448e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.72e-05 -9.14e-05 -4.69e-05 ] [ -2.88e-05 6.43e-05 2.61e-05 ] [ -3.22e-05 -3.32e-05 3.92e-05 ] [ -5.49e-05 -8.2e-06 3.8e-05 ] [ 1.94e-05 -1.39e-05 -4.19e-05 ] [ 6.93e-05 8.24e-05 -1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.357920408576e-14 -1.4643894314112e-13 -7.514208351552e-14 ] [ -4.614268667904e-14 1.0301995671744e-13 4.181680980288e-14 ] [ -5.159008718975999e-14 -5.319226381056e-14 6.280532353535999e-14 ] [ -8.795949648192e-14 -1.313784829056e-14 6.08827115904e-14 ] [ 3.108222644352e-14 -2.227025502912e-14 -6.713120041152e-14 ] [ 1.1103083982144e-13 1.3201935355392e-13 -2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.77256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.328130998616525e-18 } }