{ "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" [ [ -8.319314280046318e-09 -2.600476210583623e-09 -3.93393672984902e-09 ] [ 2.730562858479873e-09 1.305106479171775e-09 1.31590771307856e-10 ] [ -2.193046380920411e-09 4.931685170875089e-09 -3.254110438735565e-10 ] [ 5.662250953610321e-09 -2.916823100442666e-09 -6.609105773623691e-09 ] [ 2.119546688658873e-09 -7.194923390205734e-10 1.073686277603841e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9653742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.276193631916351e-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" [ [ -1.84250311392e-14 0.0 -2.24304726912e-14 ] [ 5.28718284864e-15 -4.8065298624e-16 -2.24304726912e-15 ] [ -1.44195895872e-15 -4.646312200320001e-15 -1.92261194496e-15 ] [ -6.889359469440001e-15 -1.6021766208e-15 5.76783583488e-15 ] [ 2.16293843808e-14 6.889359469440001e-15 2.08282960704e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.950872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.754523109577334e-18 } }