{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -34.7419253 -4.300168 -44.4930556 ] [ -38.6441351 7.951203 -6.1426803 ] [ -22.3573209 19.9710545 14.1679774 ] [ 17.6740343 -31.3719435 -18.6811477 ] [ 31.5790429 -9.1485982 33.3364826 ] [ 53.3718785 32.7110953 12.5158004 ] [ -6.8815743 -15.8126431 9.2966232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.566270093583344e-08 -6.889628691874511e-09 -7.128573405758284e-08 ] [ -6.191473029835925e-08 1.27392316587907e-08 -9.84165884679211e-09 ] [ -3.582037714481985e-08 3.199715687624055e-08 2.269960234132007e-08 ] [ 2.831692478397454e-08 -5.026339483886818e-08 -2.993049834124284e-08 ] [ 5.059520465846359e-08 -1.465767026989446e-08 5.341093348146755e-08 ] [ 8.551117664538695e-08 5.240895256220721e-08 2.005252295668785e-08 ] [ -1.10254975485949e-08 -2.533464729660132e-08 1.489483246614231e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.627494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.105977207477519e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.586059 3.0450244 1.0524946 ] [ 1.0060438 1.4861751 2.9576347 ] [ 1.501787 4.2430921 3.490717 ] [ 4.5094675 1.0454751 1.9788777 ] [ 3.2459665 0.8893553 4.3853003 ] [ 5.0052034 3.8023785 2.512023 ] [ 3.7140978 3.4928895 4.8887757 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586059e-10 3.0450244e-10 1.0524946e-10 ] [ 1.0060438e-10 1.4861751e-10 2.9576347e-10 ] [ 1.501787e-10 4.243092100000001e-10 3.490717e-10 ] [ 4.509467500000001e-10 1.0454751e-10 1.9788777e-10 ] [ 3.2459665e-10 8.893553e-11 4.3853003e-10 ] [ 5.0052034e-10 3.8023785e-10 2.512023e-10 ] [ 3.7140978e-10 3.4928895e-10 4.8887757e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 1.14e-05 2.56e-05 ] [ -4.2e-06 2.42e-05 -3.16e-05 ] [ -7e-07 -3.78e-05 1.27e-05 ] [ -2.7e-06 -2.1e-06 2.86e-05 ] [ 6.3e-06 1.41e-05 8.9e-06 ] [ 9e-07 8e-07 -2.96e-05 ] [ -3e-07 -1.07e-05 -1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.613059803999998e-16 1.82648136276e-14 4.10157218304e-14 ] [ -6.729141862799999e-15 3.877267454279999e-14 -5.06287816344e-14 ] [ -1.1215236438e-15 -6.056227676519999e-14 2.03476432518e-14 ] [ -4.3258769118e-15 -3.364570931399999e-15 4.58222517324e-14 ] [ 1.00937127942e-14 2.25906905394e-14 1.42593720426e-14 ] [ 1.4419589706e-15 1.2817413072e-15 -4.74244283664e-14 ] [ -4.806529901999999e-16 -1.71432899838e-14 -2.33917788564e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.619169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.143337415029714e-18 } }