{ "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" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.3802258 -10.1889111 -7.1569915 ] [ -3.5923962 -4.7189751 20.1878085 ] [ -16.8426326 14.9190312 -5.8539297 ] [ 1.6029577 -7.9025466 -6.6291458 ] [ 16.7834573 -7.6341758 9.1035414 ] [ 6.212937 2.9337055 -15.521728 ] [ 8.2159026 12.5918719 5.8704452 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.983530833698498e-08 -1.632443515582961e-08 -1.146676445656432e-08 ] [ -5.755653204290761e-09 -7.560631579357341e-09 3.234443480388752e-08 ] [ -2.698487218444392e-08 2.390292299362577e-08 -9.379029305146758e-09 ] [ 2.56822135107134e-09 -1.266127540730253e-08 -1.062106241663451e-08 ] [ 2.689006290225509e-08 -1.223129798583714e-08 1.45854811975649e-08 ] [ 9.95422240790329e-09 4.700314364412374e-09 -2.486854971601674e-08 ] [ 1.316332706448993e-08 2.017440277028847e-08 9.405490053127579e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7008716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.92944995410269e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5722164 2.2061473 2.693009 ] [ 2.4746801 2.0534533 4.9077298 ] [ 1.9256963 4.5228384 2.190813 ] [ 3.8122147 1.735859 1.8299581 ] [ 4.6270273 2.5603091 3.9840189 ] [ 4.0128596 3.8818254 0.7664293 ] [ 4.2928946 4.7972795 3.1912169 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5722164e-10 2.2061473e-10 2.693009e-10 ] [ 2.4746801e-10 2.0534533e-10 4.907729800000001e-10 ] [ 1.9256963e-10 4.522838400000001e-10 2.190813e-10 ] [ 3.8122147e-10 1.735859e-10 1.8299581e-10 ] [ 4.6270273e-10 2.5603091e-10 3.9840189e-10 ] [ 4.0128596e-10 3.8818254e-10 7.664293e-11 ] [ 4.2928946e-10 4.7972795e-10 3.1912169e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.9e-06 5.4e-06 2.69e-05 ] [ 1.95e-05 -7.4e-06 -4.63e-05 ] [ -1.47e-05 -4.5e-06 -6.8e-06 ] [ -2.01e-05 1.27e-05 1e-07 ] [ -1.88e-05 2.13e-05 2.9e-06 ] [ 1.27e-05 -2.2e-05 1.09e-05 ] [ 1.14e-05 -5.4e-06 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586154854592e-14 8.65175375232e-15 4.309855109952001e-14 ] [ 3.12424441056e-14 -1.185610699392e-14 -7.418077754303999e-14 ] [ -2.355199632576e-14 -7.2097947936e-15 -1.089480102144e-14 ] [ -3.220375007808e-14 2.034764308416e-14 1.6021766208e-16 ] [ -3.012092047104e-14 3.412636202304e-14 4.646312200320001e-15 ] [ 2.034764308416e-14 -3.52478856576e-14 1.746372516672e-14 ] [ 1.826481347712e-14 -8.65175375232e-15 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }