{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4845952 -0.4299786 0.3873581 ] [ -1.4335289 -1.2103021 1.0838934 ] [ 0.1434263 1.7710553 1.6179998 ] [ 0.9657502 -4.6717348 -3.3766082 ] [ 0.4082757 -1.1051295 -1.3160125 ] [ -0.0224392 3.0369154 -0.1926073 ] [ -1.5460792 2.6091743 1.7959768 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.3785837207919e-09 -6.889016603643149e-10 6.206160916975084e-10 ] [ -2.296766488821141e-09 -1.939117728725144e-09 1.736588664919423e-09 ] [ 2.29794264667847e-10 2.83754339580393e-09 2.592321452019076e-09 ] [ 1.547302391972924e-09 -7.484944275137764e-09 -5.409922715641571e-09 ] [ 6.541297813807545e-10 -1.770612647856394e-09 -2.10848446018056e-09 ] [ -3.595156162945536e-11 4.86567485322748e-09 -3.085909130554118e-10 ] [ -2.477091948145167e-09 4.180358063052205e-09 2.877472040459198e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.708983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.759903799034465e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0467169 2.6159271 1.2209649 ] [ 2.6196194 1.447906 3.4459506 ] [ 2.0667537 3.9343782 3.0524457 ] [ 3.9350917 1.380213 1.2305462 ] [ 5.1222095 1.9349536 3.0679521 ] [ 4.2356984 3.9036872 1.6603938 ] [ 3.9675123 3.5135138 4.1939477 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0467169e-10 2.6159271e-10 1.2209649e-10 ] [ 2.6196194e-10 1.447906e-10 3.4459506e-10 ] [ 2.0667537e-10 3.9343782e-10 3.0524457e-10 ] [ 3.9350917e-10 1.380213e-10 1.2305462e-10 ] [ 5.1222095e-10 1.9349536e-10 3.0679521e-10 ] [ 4.235698400000001e-10 3.9036872e-10 1.6603938e-10 ] [ 3.9675123e-10 3.5135138e-10 4.1939477e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.94e-05 -9e-07 6.2e-06 ] [ 6.3e-06 4.2e-06 -1.39e-05 ] [ 2.54e-05 -1.26e-05 -1.21e-05 ] [ -7e-06 3.11e-05 4.59e-05 ] [ -2.16e-05 -1e-07 -4.4e-06 ] [ -2.79e-05 -2.6e-06 2.9e-06 ] [ 5.4e-06 -1.92e-05 -2.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.108222644352e-14 -1.44195895872e-15 9.93349504896e-15 ] [ 1.009371271104e-14 6.72914180736e-15 -2.227025502912e-14 ] [ 4.069528616832e-14 -2.018742542208e-14 -1.938633711168e-14 ] [ -1.12152363456e-14 4.982769290688e-14 7.353990689472e-14 ] [ -3.460701500928e-14 -1.6021766208e-16 -7.04957713152e-15 ] [ -4.470072772032e-14 -4.16565921408e-15 4.646312200320001e-15 ] [ 8.65175375232e-15 -3.076179111936e-14 -3.92533272096e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }