{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.8713894e-10 8.033379000000001e-11 2.7951433e-10 ] [ 2.4665231e-10 2.9973251e-10 4.52443e-11 ] [ 1.0644955e-10 2.6037129e-10 2.4099819e-10 ] [ 2.2261439e-10 2.3504556e-10 4.836193100000001e-10 ] [ 2.6096211e-10 4.4012233e-10 3.409243e-10 ] [ 4.2499819e-10 2.9969907e-10 2.12764e-10 ] [ 4.6807981e-10 1.7750876e-10 4.3471094e-10 ] ] "source-value" [ [ 2.8713894 0.8033379 2.7951433 ] [ 2.4665231 2.9973251 0.452443 ] [ 1.0644955 2.6037129 2.4099819 ] [ 2.2261439 2.3504556 4.8361931 ] [ 2.6096211 4.4012233 3.409243 ] [ 4.2499819 2.9969907 2.12764 ] [ 4.6807981 1.7750876 4.3471094 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.5338423257952e-12 -8.37185349666624e-12 1.43827395249216e-12 ] [ 3.0873943482816e-12 -2.5250303543808e-13 -1.445708052012672e-11 ] [ 5.907225200889601e-12 -2.78426253162624e-12 1.752476809597248e-11 ] [ -4.07609754097728e-12 4.3843563228192e-12 -1.494862830738816e-11 ] [ -4.6078599614208e-12 1.008938683416384e-11 5.57669616401856e-12 ] [ -2.70319239461376e-12 1.70663853647616e-12 5.53664174849856e-12 ] [ 4.92653289129792e-12 -4.77192284739072e-12 -6.7067113346688e-13 ] ] "source-value" [ [ -0.0015815 -0.0052253 0.0008977 ] [ 0.001927 -0.0001576 -0.0090234 ] [ 0.003687 -0.0017378 0.0109381 ] [ -0.0025441 0.0027365 -0.0093302 ] [ -0.002876 0.0062973 0.0034807 ] [ -0.0016872 0.0010652 0.0034557 ] [ 0.0030749 -0.0029784 -0.0004186 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.650573389598122e-18 "source-value" -16.543578 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.193359426063394e-09 -7.245044922304869e-09 -5.752591604986075e-09 ] [ 1.295228419433894e-10 8.133516906909275e-10 9.149261636610816e-10 ] [ -5.348417878869314e-09 -1.178462588398301e-09 -5.529198035918323e-09 ] [ -1.091121371874348e-08 -9.267333241592362e-09 1.543733831941884e-08 ] [ 3.231489947897138e-09 1.803956282513108e-08 -5.767661838498981e-09 ] [ 1.139486277526437e-09 1.443145530725365e-09 -7.08947052828961e-09 ] [ 1.495249211652688e-08 -2.605219454469502e-09 7.786657364395406e-09 ] ] "source-value" [ [ -1.9931382 -4.5220014 -3.5904853 ] [ 0.0808418 0.5076542 0.571052 ] [ -3.3382199 -0.7355385 -3.451054 ] [ -6.810244 -5.7842145 9.6352288 ] [ 2.0169374 11.2594096 -3.5998914 ] [ 0.7112114 0.9007406 -4.4248995 ] [ 9.3326116 -1.6260501 4.8600493 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.771785921795805e-18 "source-value" -11.058618 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] } "instance-id" 1 }