{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4136244 -3.8046518 6.5671342 ] [ -4.4922939 -1.7541425 -13.5698201 ] [ -1.0228293 -0.955278 0.1918315 ] [ 4.632903 10.3077648 6.0817184 ] [ 8.2958446 -3.7936925 0.729136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.187793568907243e-08 -6.095724164244638e-09 1.052170888089611e-08 ] [ -7.197448260342453e-09 -2.810446103051664e-09 -2.174124851268192e-08 ] [ -1.63875319152923e-09 -1.530524077964582e-09 3.073479444329952e-10 ] [ 7.422728873034182e-09 1.651485977526519e-08 9.743987034769182e-09 ] [ 1.329140826790993e-08 -6.078165430004305e-09 1.168204652583629e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.796044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.210369915632812e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5986588 2.5581596 3.9587699 ] [ 1.9829929 3.3566941 1.5689609 ] [ 0.4631154 4.6811968 3.126325 ] [ 2.9794859 4.6556658 3.5224787 ] [ 3.910977 2.3658167 2.9071524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5986588e-10 2.5581596e-10 3.9587699e-10 ] [ 1.9829929e-10 3.3566941e-10 1.5689609e-10 ] [ 4.631154e-11 4.681196800000001e-10 3.126325e-10 ] [ 2.9794859e-10 4.6556658e-10 3.5224787e-10 ] [ 3.910977e-10 2.3658167e-10 2.9071524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.41e-05 1.4e-05 -3.7e-06 ] [ 4.2e-06 2.7e-06 1.93e-05 ] [ 2.7e-06 -3.9e-06 -1e-05 ] [ -7.4e-06 -2.18e-05 7e-07 ] [ -1.36e-05 8.9e-06 -6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.259069035328e-14 2.24304726912e-14 -5.928053496960001e-15 ] [ 6.72914180736e-15 4.32587687616e-15 3.092200878144e-14 ] [ 4.32587687616e-15 -6.24848882112e-15 -1.6021766208e-14 ] [ -1.185610699392e-14 -3.492745033344e-14 1.12152363456e-15 ] [ -2.178960204288e-14 1.425937192512e-14 -1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842912488295e-18 } }