{ "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" [ [ 0.7988983 0.4673865 0.2218489 ] [ 0.3258309 0.1815657 2.151485 ] [ 0.290514 2.993692 1.621534 ] [ 2.152844 0.6900228 1.637351 ] [ 2.682916 2.279137 0.4360972 ] [ 1.831466 2.039249 2.911237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.988983e-11 4.673865e-11 2.218489e-11 ] [ 3.258309e-11 1.815657e-11 2.151485e-10 ] [ 2.90514e-11 2.993692e-10 1.621534e-10 ] [ 2.152844e-10 6.900228e-11 1.637351e-10 ] [ 2.682916e-10 2.279137e-10 4.360972e-11 ] [ 1.831466e-10 2.039249e-10 2.911237e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1756701 -1.1628853 -20.5695936 ] [ -13.8448483 -6.3018047 13.6903408 ] [ -0.8436541 2.2081241 -0.4079083 ] [ 20.0041517 -10.2542198 -0.4309486 ] [ 1.6899654 4.7516854 -3.0152464 ] [ -0.8299447 10.7591003 10.7333561 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.894514251993598e-09 -1.863147640331994e-09 -3.295612196527731e-08 ] [ -2.218189226478262e-08 -1.009660415918756e-08 2.193434396054437e-08 ] [ -1.351682875062065e-09 3.537804808845041e-09 -6.535411416902727e-10 ] [ 3.205018417267658e-08 -1.642907122810445e-08 -6.904557716864909e-10 ] [ 2.70762305384092e-09 7.613039257276698e-09 -4.830957288031366e-09 ] [ -1.32971799489687e-09 1.723797896150227e-08 1.719673220614107e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.5744427209180607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.124711939043656e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7904527 0.7553314 0.026142 ] [ 0.2282068 0.478196 2.3700123 ] [ 0.171641 2.684201 1.3615239 ] [ 2.5225183 0.1994898 1.6316624 ] [ 2.4659512 2.4054854 0.6231672 ] [ 1.9036992 2.1283494 2.9670453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.904527e-11 7.553314e-11 2.6142e-12 ] [ 2.282068e-11 4.78196e-11 2.3700123e-10 ] [ 1.71641e-11 2.684201e-10 1.3615239e-10 ] [ 2.5225183e-10 1.994898e-11 1.6316624e-10 ] [ 2.4659512e-10 2.4054854e-10 6.231672e-11 ] [ 1.9036992e-10 2.1283494e-10 2.9670453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.87e-05 3.84e-05 -1.36e-05 ] [ -6e-07 1.72e-05 3.21e-05 ] [ 1.24e-05 -1.34e-05 -1.05e-05 ] [ 1.68e-05 -3.66e-05 -4.8e-06 ] [ -4.37e-05 -9.2e-06 -1.1e-06 ] [ -1.37e-05 3.6e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.598246901696e-14 6.152358223872e-14 -2.178960204288e-14 ] [ -9.6130597248e-16 2.755743787776e-14 5.142986952768e-14 ] [ 1.986699009792e-14 -2.146916671872e-14 -1.68228545184e-14 ] [ 2.691656722944e-14 -5.863966432128e-14 -7.69044777984e-15 ] [ -7.001511832895999e-14 -1.474002491136e-14 -1.76239428288e-15 ] [ -2.194981970496e-14 5.76783583488e-15 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }