{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8276633 1.0185251 0.1287522 ] [ 0.654527 -0.2013703 -0.5574701 ] [ -3.3888868 1.3606196 1.609106 ] [ -0.1980358 -0.9985202 -2.2487415 ] [ 1.4980739 -2.6055657 1.544334 ] [ -0.2686045 0.2596526 0.4855486 ] [ 0.8752629 1.166659 -0.9615292 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.326062800079332e-09 1.631857116362513e-09 2.062837664160948e-10 ] [ 1.048667865722118e-09 -3.226307894415702e-10 -8.931655683736432e-10 ] [ -5.429595246231031e-09 2.179952930882426e-09 2.578072034829204e-09 ] [ -3.172883314554972e-10 -1.599805733017007e-09 -3.602881087206111e-09 ] [ 2.400178998585252e-09 -4.174576482891854e-09 2.474295849891756e-09 ] [ -4.30351853687253e-10 4.160093286773484e-10 7.779346215914123e-10 ] [ 1.402325766987078e-09 1.869193789645806e-09 -1.540539617148712e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.54262106491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650420093532524e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1048908 1.7222553 2.7171908 ] [ 2.2129435 3.6087313 1.4813993 ] [ 2.1972901 3.4287622 3.9532503 ] [ 3.1114114 1.1629866 1.5436499 ] [ 4.2085482 1.956416 3.651645 ] [ 4.6729069 3.5626945 1.5592453 ] [ 4.3082471 4.5035962 3.7285714 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1048908e-10 1.7222553e-10 2.7171908e-10 ] [ 2.2129435e-10 3.6087313e-10 1.4813993e-10 ] [ 2.1972901e-10 3.4287622e-10 3.9532503e-10 ] [ 3.1114114e-10 1.1629866e-10 1.5436499e-10 ] [ 4.2085482e-10 1.956416e-10 3.651645e-10 ] [ 4.6729069e-10 3.5626945e-10 1.5592453e-10 ] [ 4.3082471e-10 4.5035962e-10 3.7285714e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.9e-06 1.49e-05 -1.63e-05 ] [ 4.4e-06 -1.7e-06 1.87e-05 ] [ -2.5e-05 -1.06e-05 -2.16e-05 ] [ 1.9e-06 1.04e-05 4.85e-05 ] [ 1.53e-05 -1.48e-05 -2.41e-05 ] [ -1.52e-05 7.3e-06 2.7e-06 ] [ 1.06e-05 -5.7e-06 -7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.26571954086e-14 2.38724318466e-14 -2.61154791342e-14 ] [ 7.0495771896e-15 -2.7237002778e-15 2.99607030558e-14 ] [ -4.005441585e-14 -1.69830723204e-14 -3.46070152944e-14 ] [ 3.0441356046e-15 1.66626369936e-14 7.770556674899999e-14 ] [ 2.45133025002e-14 -2.37122141832e-14 -3.86124568794e-14 ] [ -2.43530848368e-14 1.16958894282e-14 4.3258769118e-15 ] [ 1.69830723204e-14 -9.1324068138e-15 -1.26571954086e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }