{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8220215 2.269884 1.1575332 ] [ -2.0082257 -8.3486316 -0.4924682 ] [ -6.5835696 -1.9212684 -0.5016313 ] [ 3.2091511 8.296544 2.5138019 ] [ -2.1747463 -0.703183 -1.4031275 ] [ 3.8335095 2.4189866 0.0568317 ] [ 1.9018595 -2.0123316 -1.3309398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.919200249894947e-09 3.636755076727987e-09 1.854572630839811e-09 ] [ -3.217532265829715e-09 -1.33759823651921e-08 -7.890210365274586e-10 ] [ -1.054804129452961e-08 -3.078211312761823e-09 -8.037019411215111e-10 ] [ 5.141626865034603e-09 1.329252883023852e-08 4.027554633502619e-09 ] [ -3.484327678031303e-09 -1.126623362744007e-09 -2.248058076501552e-09 ] [ 6.141959296514698e-09 3.875643776548482e-09 9.105442106031935e-11 ] [ 3.047114826946378e-09 -3.224110642817057e-09 -2.132400631252228e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.503847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.804425443746022e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0148574 1.0376137 1.903415 ] [ 1.8793156 2.38017 3.5552929 ] [ 1.5829818 4.0647871 1.822953 ] [ 3.0690107 4.5741268 3.8035649 ] [ 4.3707071 2.6094494 3.1933491 ] [ 3.5805468 5.4578169 1.6176956 ] [ 3.6821716 3.1406008 0.864635 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0148574e-10 1.0376137e-10 1.903415e-10 ] [ 1.8793156e-10 2.38017e-10 3.5552929e-10 ] [ 1.5829818e-10 4.0647871e-10 1.822953e-10 ] [ 3.069010700000001e-10 4.5741268e-10 3.8035649e-10 ] [ 4.3707071e-10 2.6094494e-10 3.1933491e-10 ] [ 3.5805468e-10 5.4578169e-10 1.6176956e-10 ] [ 3.6821716e-10 3.1406008e-10 8.646350000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 4.76e-05 -5.8e-06 ] [ 4.48e-05 -1.89e-05 -2.35e-05 ] [ -2.42e-05 1.12e-05 4.2e-06 ] [ 1.75e-05 7.1e-06 -1.59e-05 ] [ -3.25e-05 -6.09e-05 2.37e-05 ] [ -1.71e-05 1.62e-05 -4.22e-05 ] [ 4.2e-06 -2.3e-06 5.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 7.626360715008e-14 -9.292624400640001e-15 ] [ 7.177751261183999e-14 -3.028113813312e-14 -3.76511505888e-14 ] [ -3.877267422336e-14 1.794437815296e-14 6.72914180736e-15 ] [ 2.8038090864e-14 1.137545400768e-14 -2.547460827072e-14 ] [ -5.207074017599999e-14 -9.757255620672e-14 3.797158591296e-14 ] [ -2.739722021568e-14 2.595526125696e-14 -6.761185339776e-14 ] [ 6.72914180736e-15 -3.68500622784e-15 9.516929127552e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.501501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.444920221430782e-18 } }