{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.4257612e-10 1.9477695e-10 3.7185496e-10 ] [ 8.360035000000001e-11 3.8495539e-10 5.013561100000001e-10 ] [ 1.0260287e-10 4.0591695e-10 2.6553727e-10 ] [ 3.6446871e-10 2.0073799e-10 3.0053348e-10 ] [ 4.4895761e-10 5.7777657e-10 2.853911e-10 ] [ 3.2497012e-10 4.0447295e-10 1.9387309e-10 ] ] "source-value" [ [ 1.4257612 1.9477695 3.7185496 ] [ 0.8360035 3.8495539 5.0135611 ] [ 1.0260287 4.0591695 2.6553727 ] [ 3.6446871 2.0073799 3.0053348 ] [ 4.4895761 5.7777657 2.853911 ] [ 3.2497012 4.0447295 1.9387309 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.59832847265472e-12 -3.01785988293888e-12 2.18729152271616e-12 ] [ -4.7536580339136e-13 1.61275098649728e-12 2.71600980758016e-12 ] [ 6.12864600988416e-12 2.36369116866624e-12 -3.25946811735552e-12 ] [ -5.7293835959808e-12 4.502116304448e-14 -1.24953754656192e-12 ] [ -5.920042613856e-12 -1.87486708166016e-12 1.28782956779904e-12 ] [ 2.39781753068928e-12 8.7126364639104e-13 -1.68212523417792e-12 ] ] "source-value" [ [ 0.0022459 -0.0018836 0.0013652 ] [ -0.0002967 0.0010066 0.0016952 ] [ 0.0038252 0.0014753 -0.0020344 ] [ -0.003576 2.81e-05 -0.0007799 ] [ -0.003695 -0.0011702 0.0008038 ] [ 0.0014966 0.0005438 -0.0010499 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.608478441933871e-18 "source-value" -16.280842 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.418409205441509e-09 -5.115831501004398e-09 -2.824022627300999e-09 ] [ -2.207090900960682e-09 -3.126481049122637e-10 5.564053708739152e-09 ] [ -1.846580813637598e-09 5.927987166847899e-09 -1.648556910271905e-09 ] [ 2.259245595191612e-09 -1.806083236064285e-09 -1.61275098649728e-11 ] [ -7.217177623468646e-10 -1.542268993901019e-09 1.265850908914906e-10 ] [ 3.934553087195042e-09 2.84884482925173e-09 -1.201931591975103e-09 ] ] "source-value" [ [ -0.8853014 -3.1930509 -1.7626163 ] [ -1.3775578 -0.1951396 3.4728092 ] [ -1.1525451 3.6999586 -1.0289483 ] [ 1.4101102 -1.1272685 -0.010066 ] [ -0.4504608 -0.9626086 0.0790082 ] [ 2.4557549 1.7781091 -0.7501867 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.314294301052693e-18 "source-value" -14.444689 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.246824e-10 2.123997e-10 2.925379e-10 ] [ 6.864707e-11 2.951046e-10 4.893167e-10 ] [ 1.520727e-10 4.392498e-10 3.389756e-10 ] [ 3.328529e-10 2.438693e-10 3.945927e-10 ] [ 4.586805e-10 5.929425e-10 1.979745e-10 ] [ 3.302402e-10 3.850709e-10 2.051486e-10 ] ] "source-value" [ [ 1.246824 2.123997 2.925379 ] [ 0.6864707 2.951046 4.893167 ] [ 1.520727 4.392498 3.389756 ] [ 3.328529 2.438693 3.945927 ] [ 4.586805 5.929425 1.979745 ] [ 3.302402 3.850709 2.051486 ] ] } "instance-id" 1 }