{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.972525 2.2923418 -6.0228997 ] [ -0.0159155 -1.9980727 4.8990975 ] [ -1.4144858 -10.1654803 -2.3299857 ] [ -5.3867864 2.7325463 -2.8786559 ] [ 2.8446627 7.1386649 6.3324437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.36468673298085e-09 3.672736469101501e-09 -9.64974916826561e-09 ] [ -2.5499442218427e-11 -3.201265392973292e-09 7.849219542187814e-09 ] [ -2.266256097884797e-09 -1.628689501004731e-08 -3.733048646094133e-09 ] [ -8.630583302428977e-09 4.378021833183154e-09 -4.61211522030624e-09 ] [ 4.557652109551352e-09 1.143740210073595e-08 1.014569333226051e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3099732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.331404489020621e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1135198 2.9652034 0.129796 ] [ 0.6714342 1.9380737 2.2425277 ] [ 1.7807911 0.1706582 1.007945 ] [ 2.4517404 2.3774025 0.2604191 ] [ 2.8317598 2.9651386 2.571284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.135198e-11 2.9652034e-10 1.29796e-11 ] [ 6.714342e-11 1.9380737e-10 2.2425277e-10 ] [ 1.7807911e-10 1.706582e-11 1.007945e-10 ] [ 2.4517404e-10 2.3774025e-10 2.604191e-11 ] [ 2.8317598e-10 2.9651386e-10 2.571284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.81e-05 3.05e-05 -7.3e-06 ] [ -0.0001566 -4.7e-06 0.0001675 ] [ 3.24e-05 -8.4e-06 -5.61e-05 ] [ 0.0001946 -5.23e-05 -0.0001302 ] [ 1.78e-05 3.49e-05 2.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.411517614554e-13 4.886638733699999e-14 -1.16958894282e-14 ] [ -2.509008608844e-13 -7.530230179799999e-15 2.68364586195e-13 ] [ 5.19105229416e-14 -1.34582837256e-14 -8.988210916739999e-14 ] [ 3.117835729763999e-13 -8.379383795819998e-14 -2.086033977468e-13 ] [ 2.851874408519999e-14 5.59159645266e-14 4.165659248399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.390494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.465828987251719e-18 } }