{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1925076 -1.6230896 -2.4553702 ] [ 1.7042833 0.8145834 0.0821325 ] [ -1.3687919 3.0781158 -0.2031056 ] [ 3.5340991 -1.8205378 -4.1250794 ] [ 1.322917 -0.4490718 6.7014227 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.319314348587417e-09 -2.600476232008406e-09 -3.933936762259906e-09 ] [ 2.730562880976412e-09 1.305106489924275e-09 1.31590772392005e-10 ] [ -2.193046398988464e-09 4.931685211506216e-09 -3.254110465545504e-10 ] [ 5.662251000260429e-09 -2.916823124473765e-09 -6.609105828074738e-09 ] [ 2.119546706121378e-09 -7.194923449483211e-10 1.073686286449719e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9653742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.276193642430644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.062623 2.411852 1.423028 ] [ 2.2445768 1.5010408 3.6915437 ] [ 2.6019377 4.5874418 2.4153986 ] [ 4.4823549 2.060073 1.2498255 ] [ 4.1566237 3.0205144 3.4814842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.062623e-10 2.411852e-10 1.423028e-10 ] [ 2.2445768e-10 1.5010408e-10 3.6915437e-10 ] [ 2.6019377e-10 4.5874418e-10 2.4153986e-10 ] [ 4.4823549e-10 2.060073e-10 1.2498255e-10 ] [ 4.1566237e-10 3.0205144e-10 3.4814842e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.15e-05 0.0 -1.4e-05 ] [ 3.3e-06 -3e-07 -1.4e-06 ] [ -9e-07 -2.9e-06 -1.2e-06 ] [ -4.3e-06 -1e-06 3.6e-06 ] [ 1.35e-05 4.3e-06 1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.8425031291e-14 0.0 -2.243047287599999e-14 ] [ 5.2871828922e-15 -4.806529901999999e-16 -2.2430472876e-15 ] [ -1.4419589706e-15 -4.6463122386e-15 -1.9226119608e-15 ] [ -6.8893595262e-15 -1.602176634e-15 5.767835882399999e-15 ] [ 2.162938455899999e-14 6.8893595262e-15 2.082829624199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.950872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.754523124032485e-18 } }