{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8272177 -0.0886647 -3.2269919 ] [ -4.6892848 1.5634348 4.6663597 ] [ -0.1748755 -7.8001009 -1.8794782 ] [ 5.830088 2.7078552 3.4194169 ] [ -0.5037396 2.043939 -0.0628272 ] [ 7.7467396 -0.1461571 -4.3771392 ] [ -0.3817098 1.7196936 1.4606598 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.254058530817122e-08 -1.420565106006198e-10 -5.170211020287263e-09 ] [ -7.513062536731363e-09 2.504898705342463e-09 7.47633247717925e-09 ] [ -2.801814399590669e-10 -1.249713940482237e-08 -3.011256056152379e-09 ] [ 9.340830767763792e-09 4.338462329695396e-09 5.478509859084714e-09 ] [ -8.070798167405063e-10 3.274751307121326e-09 -1.006602718196448e-10 ] [ 1.24116451768025e-08 -2.341694905132014e-10 -7.012950150005452e-09 ] [ -6.115665225288131e-10 2.755252903559342e-09 2.340235001783113e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.568077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853410266971282e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5641544 2.7998264 1.4966424 ] [ 2.2948423 2.80143 3.9304614 ] [ 3.3446092 1.0686121 1.6692208 ] [ 5.2657501 3.3745334 3.6792378 ] [ 3.2429262 4.541342 1.028256 ] [ 5.0363366 2.8064885 1.3043805 ] [ 3.4191482 5.0263486 3.4374601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5641544e-10 2.7998264e-10 1.4966424e-10 ] [ 2.2948423e-10 2.80143e-10 3.9304614e-10 ] [ 3.3446092e-10 1.0686121e-10 1.6692208e-10 ] [ 5.265750100000001e-10 3.3745334e-10 3.6792378e-10 ] [ 3.2429262e-10 4.541342000000001e-10 1.028256e-10 ] [ 5.0363366e-10 2.8064885e-10 1.3043805e-10 ] [ 3.4191482e-10 5.026348600000001e-10 3.4374601e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 -2.42e-05 1.61e-05 ] [ -3.87e-05 1.51e-05 4.2e-06 ] [ -1.37e-05 1.25e-05 -1.71e-05 ] [ 1.86e-05 1.45e-05 1.08e-05 ] [ -7.4e-06 4e-06 -3e-06 ] [ 1.07e-05 5.6e-06 -3.9e-06 ] [ 1.82e-05 -2.75e-05 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.95465549348e-14 -3.877267454279999e-14 2.579504380739999e-14 ] [ -6.200423573579999e-14 2.41928671734e-14 6.729141862799999e-15 ] [ -2.19498198858e-14 2.0027207925e-14 -2.73972204414e-14 ] [ 2.98004853924e-14 2.3231561193e-14 1.73035076472e-14 ] [ -1.18561070916e-14 6.408706535999999e-15 -4.806529901999999e-15 ] [ 1.71432899838e-14 8.972189150399999e-15 -6.248488872599999e-15 ] [ 2.915961473879999e-14 -4.4059857435e-14 -1.16958894282e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.606128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.981030353081315e-18 } }