{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2276944 -0.1687026 -2.5922081 ] [ -6.8803857 -0.7733434 3.2889813 ] [ -20.926438 0.7674921 0.1622942 ] [ 3.4927479 -9.4562421 -3.8677798 ] [ 2.6965933 -4.3630416 3.913104 ] [ 16.6606349 7.6551426 -5.7018547 ] [ 4.7291533 6.3386951 4.7974631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.648066443670835e-10 -2.702913615881741e-10 -4.153175214068389e-09 ] [ -1.102359311062664e-08 -1.239032715329983e-09 5.269528945108391e-09 ] [ -3.352784972022072e-08 1.229657899268696e-09 2.600239729314394e-10 ] [ 5.595999027728297e-09 -1.51505700132447e-08 -6.1968663699625e-09 ] [ 4.32041874106592e-09 -6.990363247097825e-09 6.269483743558964e-09 ] [ 2.669327972446455e-08 1.226489050261013e-08 -9.135378295538598e-09 ] [ 7.576938853439169e-09 1.015570909559952e-08 7.686383217970692e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.437943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.793866458944302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3626504 1.148563 1.4128681 ] [ 1.107754 1.8283715 3.92931 ] [ 1.329721 3.7114661 1.9514157 ] [ 3.8694675 1.1571455 1.7023641 ] [ 3.6341113 1.1992658 4.2145039 ] [ 3.9263263 3.6783292 1.6106385 ] [ 3.0551216 3.7499797 4.0795367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3626504e-10 1.148563e-10 1.4128681e-10 ] [ 1.107754e-10 1.8283715e-10 3.92931e-10 ] [ 1.329721e-10 3.7114661e-10 1.9514157e-10 ] [ 3.8694675e-10 1.1571455e-10 1.7023641e-10 ] [ 3.6341113e-10 1.1992658e-10 4.214503900000001e-10 ] [ 3.9263263e-10 3.6783292e-10 1.6106385e-10 ] [ 3.0551216e-10 3.7499797e-10 4.0795367e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 5.7e-06 7e-06 ] [ 4.3e-06 -3.2e-06 -2.7e-06 ] [ 1.2e-06 -1.6e-06 -2e-07 ] [ 3e-07 3e-07 -1e-07 ] [ -4.1e-06 6e-07 -1.7e-06 ] [ -9e-07 -1.3e-06 2.8e-06 ] [ -1.8e-06 -6e-07 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-15 9.13240673856e-15 1.12152363456e-14 ] [ 6.889359469440001e-15 -5.126965186560001e-15 -4.32587687616e-15 ] [ 1.92261194496e-15 -2.56348259328e-15 -3.2043532416e-16 ] [ 4.8065298624e-16 4.8065298624e-16 -1.6021766208e-16 ] [ -6.568924145279999e-15 9.6130597248e-16 -2.72370025536e-15 ] [ -1.44195895872e-15 -2.08282960704e-15 4.48609453824e-15 ] [ -2.88391791744e-15 -9.6130597248e-16 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.044153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.852297980353818e-18 } }