{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8294732 -2.8092308 -4.0463193 ] [ -4.1033666 -2.3748418 0.8293097 ] [ 0.7448329 1.1460548 1.6677071 ] [ -1.9055355 3.9064241 -2.0524911 ] [ 0.2607729 -1.2947401 -0.3312348 ] [ 2.3491468 1.6772247 -1.290264 ] [ 4.4836228 -0.2508908 5.2232924 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.931139189420163e-09 -4.500883910191281e-09 -6.482918182751822e-09 ] [ -6.574318033091586e-09 -3.80491601005859e-09 1.328700612742662e-09 ] [ 1.193353858782664e-09 1.83618220671562e-09 2.671961325962168e-09 ] [ -3.053004428204439e-09 6.258781363949681e-09 -3.288453254820075e-09 ] [ 4.178042437182163e-10 -2.074402318232254e-09 -5.306966525553639e-10 ] [ 3.763748081787134e-09 2.687210202168294e-09 -2.067230815459891e-09 ] [ 7.183555626645835e-09 -4.019713741338087e-10 8.368636966882322e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.028393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.407813991279437e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1894841 -0.2205261 2.4593474 ] [ 0.7385465 1.0838157 3.8741144 ] [ 2.218529 2.6374672 4.8701516 ] [ 2.8105876 4.1621514 3.161041 ] [ 4.3131283 0.7544801 2.8278105 ] [ 4.2615297 2.8577927 1.7462852 ] [ 4.1956797 1.3622616 5.1103059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1894841e-10 -2.205261e-11 2.4593474e-10 ] [ 7.385465e-11 1.0838157e-10 3.8741144e-10 ] [ 2.218529e-10 2.6374672e-10 4.8701516e-10 ] [ 2.8105876e-10 4.1621514e-10 3.161041e-10 ] [ 4.3131283e-10 7.544801e-11 2.8278105e-10 ] [ 4.2615297e-10 2.8577927e-10 1.7462852e-10 ] [ 4.1956797e-10 1.3622616e-10 5.110305900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-07 -1.19e-05 2.13e-05 ] [ -3.03e-05 2.05e-05 -6.3e-06 ] [ -1.34e-05 -2.22e-05 7.2e-06 ] [ 1.23e-05 1.08e-05 -4.56e-05 ] [ 1.94e-05 3.2e-05 3.2e-06 ] [ -1.82e-05 7e-07 4.53e-05 ] [ 2.93e-05 -2.99e-05 -2.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-15 -1.906590178752e-14 3.412636202304e-14 ] [ -4.854595161024e-14 3.28446207264e-14 -1.009371271104e-14 ] [ -2.146916671872e-14 -3.556832098176e-14 1.153567166976e-14 ] [ 1.970677243584e-14 1.730350750464e-14 -7.305925390848e-14 ] [ 3.108222644352e-14 5.12696518656e-14 5.126965186560001e-15 ] [ -2.915961449856e-14 1.12152363456e-15 7.257860092224001e-14 ] [ 4.694377498944e-14 -4.790508096192e-14 -4.021463318208e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }