{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8956639 -3.1665093 -0.25013 ] [ -3.984521 3.5819402 -3.6627918 ] [ 1.1863577 0.1524906 3.8497026 ] [ 0.3905615 -1.3082149 1.0537939 ] [ 0.1038621 -0.0980792 0.9529855 ] [ 0.4893373 0.4496997 1.4437222 ] [ -1.0812616 0.3886728 -3.3872824 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.639365040497313e-09 -5.073307211803696e-09 -4.0075244146242e-10 ] [ -6.383906443882313e-09 5.738900892825286e-09 -5.8684394371668e-09 ] [ 1.900754586505982e-09 2.443168762246404e-10 6.167903553569048e-09 ] [ 6.25748509439991e-10 -2.095991345030646e-09 1.688363963631733e-09 ] [ 1.664054297781714e-10 -1.571402025214128e-10 1.526851100640807e-09 ] [ 7.840047882046481e-10 7.204983516568096e-10 2.313097974827075e-09 ] [ -1.732372070761454e-09 6.227224784313551e-10 -5.427024714039441e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.795610064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.530735736578427e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0880928 1.3703993 2.4362617 ] [ 1.4584773 2.9941527 1.5295401 ] [ 1.9312939 2.4708773 4.3244321 ] [ 2.8160164 4.6242972 3.0915222 ] [ 4.8158163 3.0651913 2.4613494 ] [ 3.4230888 4.0219579 0.6758046 ] [ 4.1229374 3.2474193 4.8129266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0880928e-10 1.3703993e-10 2.4362617e-10 ] [ 1.4584773e-10 2.9941527e-10 1.5295401e-10 ] [ 1.9312939e-10 2.4708773e-10 4.3244321e-10 ] [ 2.8160164e-10 4.6242972e-10 3.0915222e-10 ] [ 4.8158163e-10 3.0651913e-10 2.4613494e-10 ] [ 3.4230888e-10 4.0219579e-10 6.758046e-11 ] [ 4.1229374e-10 3.2474193e-10 4.812926600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.45e-05 -1.38e-05 4.75e-05 ] [ -1.49e-05 5e-07 4.39e-05 ] [ 1.3e-06 1.38e-05 -4.09e-05 ] [ -3.66e-05 -6.11e-05 2.9e-06 ] [ 2.7e-06 3.41e-05 -2e-07 ] [ 5.52e-05 3.79e-05 -5.58e-05 ] [ 2.69e-05 -1.15e-05 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.527509387299999e-14 -2.21100375492e-14 7.6103390115e-14 ] [ -2.38724318466e-14 8.010883169999999e-16 7.03355542326e-14 ] [ 2.0828296242e-15 2.21100375492e-14 -6.552902433059999e-14 ] [ -5.86396648044e-14 -9.789299233739998e-14 4.6463122386e-15 ] [ 4.3258769118e-15 5.46342232194e-14 -3.204353268e-16 ] [ 8.844015019679999e-14 6.072249442859999e-14 -8.940145617719999e-14 ] [ 4.309855145459999e-14 -1.8425031291e-14 4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.180097064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.912772672126102e-18 } }