{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8133662 -3.3124194 -5.5836304 ] [ -4.1464481 -5.142372 7.1565037 ] [ 3.0910781 5.1290158 -2.1993673 ] [ -0.4677574 5.2027914 4.175211 ] [ 4.9562595 -5.2110972 -6.8164307 ] [ 5.3530112 3.0067544 3.5207075 ] [ -1.972777 0.327327 -0.2529938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.091621603458894e-08 -5.307080920964363e-09 -8.945962086068152e-09 ] [ -6.643342205180579e-09 -8.238988193856538e-09 1.14659829148087e-08 ] [ 4.952453064886884e-09 8.217589202473809e-09 -3.52377486861202e-09 ] [ -7.494299704861938e-10 8.335790743979301e-09 6.689425451106989e-09 ] [ 7.940803097517897e-09 -8.349098102556343e-09 -1.092112590484338e-08 ] [ 8.576469395520553e-09 4.817351604167532e-09 5.640795245175217e-09 ] [ -3.160737187451962e-09 5.244356667566016e-10 -4.05340751567351e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.444937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.993898710872889e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6651211 1.8641692 2.3490411 ] [ 1.9736203 1.7741591 4.7241054 ] [ 2.4035423 4.195669 2.398607 ] [ 2.167978 4.3731194 4.7838804 ] [ 3.847857 1.2676571 1.5600084 ] [ 4.3042233 2.8815134 4.8718188 ] [ 4.672726 3.2931488 2.5396599 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6651211e-10 1.8641692e-10 2.3490411e-10 ] [ 1.9736203e-10 1.7741591e-10 4.724105400000001e-10 ] [ 2.4035423e-10 4.195669e-10 2.398607e-10 ] [ 2.167978e-10 4.3731194e-10 4.7838804e-10 ] [ 3.847857e-10 1.2676571e-10 1.5600084e-10 ] [ 4.3042233e-10 2.8815134e-10 4.8718188e-10 ] [ 4.672726e-10 3.2931488e-10 2.5396599e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.19e-05 -2.37e-05 -5.4e-06 ] [ -9.8e-06 1.81e-05 -7.6e-06 ] [ 9e-06 -4.66e-05 6.6e-06 ] [ 5.83e-05 1e-06 1.8e-06 ] [ -8.9e-06 4.11e-05 -1e-06 ] [ -4.18e-05 5.7e-06 8.1e-06 ] [ -2.87e-05 4.4e-06 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.508766799552e-14 -3.797158591296e-14 -8.65175375232e-15 ] [ -1.570133088384e-14 2.899939683648e-14 -1.217654231808e-14 ] [ 1.44195895872e-14 -7.466143052928e-14 1.057436569728e-14 ] [ 9.340689699264e-14 1.6021766208e-15 2.88391791744e-15 ] [ -1.425937192512e-14 6.584945911488e-14 -1.6021766208e-15 ] [ -6.697098274944e-14 9.13240673856e-15 1.297763062848e-14 ] [ -4.598246901696e-14 7.04957713152e-15 -4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }