{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.382185 0.3943114 1.075216 ] [ 0.9807846 1.486461 2.753824 ] [ 0.491957 1.894504 0.6685531 ] [ 1.794418 2.681383 2.23804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.382185e-10 3.943114e-11 1.075216e-10 ] [ 9.807846e-11 1.486461e-10 2.753824e-10 ] [ 4.91957e-11 1.894504e-10 6.685531000000001e-11 ] [ 1.794418e-10 2.681383e-10 2.23804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.8395275 -21.087085 -1.7778425 ] [ -22.0073688 -31.2091304 25.4949737 ] [ -12.7568294 15.5506512 -13.2362244 ] [ 24.9246707 36.7455642 -10.4809069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.576466092021868e-08 -3.378523458782237e-08 -2.848417688964624e-09 ] [ -3.525969177668334e-08 -5.000253908237856e-08 4.084745081005087e-08 ] [ -2.043869382021409e-08 2.491488979085547e-08 -2.12067692813425e-08 ] [ 3.993372467667877e-08 5.887288387934545e-08 -1.67922639999614e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.126616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.103115726541921e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7586929 0.9801568 0.8558918 ] [ 1.5831416 1.8906906 2.6823899 ] [ -0.0691951 0.4422524 -1.1106658 ] [ 2.3767053 3.1435596 4.3080172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.586929000000001e-11 9.801568000000001e-11 8.558918e-11 ] [ 1.5831416e-10 1.8906906e-10 2.6823899e-10 ] [ -6.919509999999999e-12 4.422524e-11 -1.1106658e-10 ] [ 2.3767053e-10 3.1435596e-10 4.3080172e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0048648 -0.0015238 -0.0121317 ] [ 0.0045137 0.0088352 0.008645 ] [ 0.0017315 -0.0019371 0.0051903 ] [ -0.0013804 -0.0053744 -0.0017037 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.794268824867841e-12 -2.44139673477504e-12 -1.943712611055936e-11 ] [ 7.23174461330496e-12 1.415555088009216e-11 1.3850816886816e-11 ] [ 2.7741688189152e-12 -3.10357633215168e-12 8.31577731493824e-12 ] [ -2.21164460735232e-12 -8.61073803082752e-12 -2.72962830885696e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.4171226 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.348571704412731e-18 } }