{ "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" [ [ -9.1965693 0.4790533 7.8243352 ] [ 1.8350438 -1.2929203 -0.5904156 ] [ -6.7078338 4.4658567 -4.9059314 ] [ 8.8288651 -10.7606016 -7.2178694 ] [ 0.9080879 -1.5609552 3.9393739 ] [ 0.8947716 2.9939741 -2.5677787 ] [ 3.4376347 5.675593 3.518286 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.473452832402702e-08 7.675279973770887e-10 1.253596693074249e-08 ] [ 2.940064274503991e-09 -2.071486677217723e-09 -9.459500708756045e-10 ] [ -1.074713449057202e-08 7.155091196583039e-09 -7.860168592328614e-09 ] [ 1.414540125141705e-08 -1.724038430926307e-08 -1.156430160466772e-08 ] [ 1.454917203011368e-09 -2.500925927556189e-09 6.311572763169717e-09 ] [ 1.433582138475809e-09 4.796875306300721e-09 -4.114035000528217e-09 ] [ 5.507697947190822e-09 9.093302413776135e-09 5.636915574487949e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.8523276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.569932595582575e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.443447 1.608009 3.9344893 ] [ 1.2493364 4.4207418 2.9548125 ] [ 2.0701526 4.9218194 1.3554104 ] [ 5.213789 1.4013475 3.042535 ] [ 4.3479308 1.9475595 4.9988597 ] [ 6.0381803 4.1954369 1.362107 ] [ 6.4110829 5.5637339 2.5752011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.443447e-10 1.608009e-10 3.9344893e-10 ] [ 1.2493364e-10 4.4207418e-10 2.9548125e-10 ] [ 2.0701526e-10 4.9218194e-10 1.3554104e-10 ] [ 5.213789000000001e-10 1.4013475e-10 3.042535e-10 ] [ 4.3479308e-10 1.9475595e-10 4.9988597e-10 ] [ 6.0381803e-10 4.1954369e-10 1.362107e-10 ] [ 6.4110829e-10 5.5637339e-10 2.5752011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 -7.6e-06 -8.09e-05 ] [ -1.93e-05 5.05e-05 -0.0001438 ] [ -0.0001171 -1.4e-05 0.0001746 ] [ -2.15e-05 -2.5e-06 -1.21e-05 ] [ 5.45e-05 6.7e-06 7e-05 ] [ 9.16e-05 -4.73e-05 5.21e-05 ] [ 5e-06 1.42e-05 -5.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-14 -1.217654231808e-14 -1.2961608862272e-13 ] [ -3.092200878144e-14 8.090991935040001e-14 -2.3039299807104e-13 ] [ -1.8761488229568e-13 -2.24304726912e-14 2.7974003799168e-13 ] [ -3.44467973472e-14 -4.005441552e-15 -1.938633711168e-14 ] [ 8.731862583360001e-14 1.073458335936e-14 1.12152363456e-13 ] [ 1.4675937846528e-13 -7.578295416384e-14 8.347340194367999e-14 ] [ 8.010883104e-15 2.275090801536e-14 -9.581016192383999e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.919447 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.793623849066471e-18 } }