{ "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" [ [ -14.6282562 -9.2295803 -0.9240808 ] [ 6.9420374 -5.1427091 -3.9712359 ] [ 5.8337219 -20.2513872 6.7165246 ] [ 10.4875611 11.7660366 -3.4642716 ] [ -8.2291377 3.5757469 -18.2000841 ] [ 7.2174146 2.3152972 13.7919606 ] [ -7.6233411 16.9665959 6.0511871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.343705008671265e-08 -1.478741777645625e-08 -1.480540653490161e-09 ] [ 1.112237002299922e-08 -8.239528287595409e-09 -6.362621314661647e-09 ] [ 9.346652840428955e-09 -3.244629911060837e-08 1.076105868714807e-08 ] [ 1.680292520363153e-08 1.885126875999712e-08 -5.550374965621409e-09 ] [ -1.318453203228389e-08 5.728978085078075e-09 -2.915974924161381e-08 ] [ 1.156357293474058e-08 3.709515044043701e-09 2.209715682831474e-08 ] [ -1.221393888280376e-08 2.718348328554114e-08 9.695070499706552e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6190035 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.196106177493373e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3206157 2.4639307 2.6496293 ] [ 5.5980467 1.7905298 1.5176507 ] [ 4.3695474 1.4866698 3.5609233 ] [ 5.5908456 4.3165349 2.1621158 ] [ 3.6112903 3.3298003 0.8251734 ] [ 4.8751971 3.7372982 4.3749261 ] [ 2.5313661 4.2236914 4.2625643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3206157e-10 2.4639307e-10 2.6496293e-10 ] [ 5.598046700000001e-10 1.7905298e-10 1.5176507e-10 ] [ 4.3695474e-10 1.4866698e-10 3.5609233e-10 ] [ 5.5908456e-10 4.3165349e-10 2.1621158e-10 ] [ 3.6112903e-10 3.3298003e-10 8.251733999999999e-11 ] [ 4.8751971e-10 3.7372982e-10 4.3749261e-10 ] [ 2.5313661e-10 4.2236914e-10 4.262564300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-05 -1.8e-06 -1.18e-05 ] [ -6.8e-06 2.84e-05 -7.9e-06 ] [ -1.06e-05 -3.03e-05 8.9e-06 ] [ 3.03e-05 1.15e-05 -1.54e-05 ] [ -7.2e-06 -2.24e-05 2.1e-06 ] [ -1.87e-05 1.73e-05 2.26e-05 ] [ 2.4e-05 -2.6e-06 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-14 -2.88391791744e-15 -1.890568412544e-14 ] [ -1.089480102144e-14 4.550181603071999e-14 -1.265719530432e-14 ] [ -1.698307218048e-14 -4.854595161024e-14 1.425937192512e-14 ] [ 4.854595161024e-14 1.84250311392e-14 -2.467351996032e-14 ] [ -1.153567166976e-14 -3.588875630592e-14 3.36457090368e-15 ] [ -2.996070280896e-14 2.771765553984e-14 3.620919163008e-14 ] [ 3.84522388992e-14 -4.16565921408e-15 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }