{ "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" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2046346 -3.6381233 2.1589428 ] [ 3.0862278 -2.004295 -3.1756096 ] [ 2.4000427 -6.0748521 1.8441359 ] [ 2.8444186 4.7661981 1.3758638 ] [ -1.4900798 -0.1606646 -7.1628056 ] [ 2.1594291 0.0305505 4.1329639 ] [ -1.7954039 7.0811865 0.8265088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.154309711752676e-08 -5.828916094847745e-09 3.459007679804491e-09 ] [ 4.944682027623018e-09 -3.211234590186336e-09 -5.08788745790804e-09 ] [ 3.845292302861709e-09 -9.732986009437784e-09 2.954631424557966e-09 ] [ 4.557260980688667e-09 7.636291165921381e-09 2.204376813765047e-09 ] [ -2.38737101868634e-09 -2.574130659101837e-10 -1.147607967165532e-08 ] [ 3.459786818295186e-09 4.89472968537504e-11 6.621738135190389e-09 ] [ -2.876554153473141e-09 1.134531145782458e-08 1.324213076245463e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.211486158928928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.747544662658721e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0663929 2.2976632 2.9767729 ] [ 5.745023 2.2163845 1.5187042 ] [ 4.2855639 1.4597633 3.2505426 ] [ 5.3689258 4.4127177 2.4303539 ] [ 3.5497497 3.0941177 1.3030074 ] [ 4.8330297 3.4038041 4.5234285 ] [ 3.0482242 4.4640045 3.3501735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0663929e-10 2.2976632e-10 2.9767729e-10 ] [ 5.745023e-10 2.2163845e-10 1.5187042e-10 ] [ 4.2855639e-10 1.4597633e-10 3.2505426e-10 ] [ 5.3689258e-10 4.4127177e-10 2.4303539e-10 ] [ 3.5497497e-10 3.0941177e-10 1.3030074e-10 ] [ 4.8330297e-10 3.4038041e-10 4.5234285e-10 ] [ 3.0482242e-10 4.4640045e-10 3.3501735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.91e-05 1.43e-05 1.05e-05 ] [ 2.59e-05 -1.82e-05 2.9e-06 ] [ 4.4e-06 -5.37e-05 -1.82e-05 ] [ -2.7e-06 4.58e-05 -3.77e-05 ] [ -1.62e-05 1.37e-05 -4.7e-06 ] [ 5.8e-06 1.3e-06 6.53e-05 ] [ 1.8e-06 -3.2e-06 -1.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.060157345728e-14 2.291112567744e-14 1.68228545184e-14 ] [ 4.149637447872e-14 -2.915961449856e-14 4.646312200320001e-15 ] [ 7.04957713152e-15 -8.603688453696e-14 -2.915961449856e-14 ] [ -4.32587687616e-15 7.337968923264e-14 -6.040205860416e-14 ] [ -2.595526125696e-14 2.194981970496e-14 -7.53023011776e-15 ] [ 9.292624400640001e-15 2.08282960704e-15 1.0462213333824e-13 ] [ 2.88391791744e-15 -5.126965186560001e-15 -2.88391791744e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.097630158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297383372452091e-18 } }