{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2090996 -0.8146876 0.9128037 ] [ -0.6047904 -2.2240174 2.11851 ] [ 7.0872363 -20.6689801 18.2116629 ] [ -4.6690355 22.1681515 -19.3851518 ] [ 1.3956892 1.5395336 -1.8578248 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.141544352938631e-09 -1.305273425975662e-09 1.462472747519737e-09 ] [ -9.689810393642802e-10 -3.563268682532402e-09 3.394227192931008e-09 ] [ 1.13550043059451e-08 -3.311535669200044e-08 2.917830052427073e-08 ] [ -7.480619519785238e-09 3.551729405965245e-08 -3.105843700461904e-08 ] [ 2.236140606143055e-09 2.466604740856059e-09 -2.976563460102436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3020462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.009699108484148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3877319 0.6786512 2.5602694 ] [ 0.3495174 2.3988073 0.9037325 ] [ 2.534937 -0.3348638 2.658457 ] [ 2.4441984 2.0017127 2.1648779 ] [ 2.4700878 2.5843131 -0.1527438 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.877319000000001e-11 6.786512000000001e-11 2.5602694e-10 ] [ 3.495174e-11 2.3988073e-10 9.037325000000001e-11 ] [ 2.534937e-10 -3.348638e-11 2.658457e-10 ] [ 2.4441984e-10 2.0017127e-10 2.1648779e-10 ] [ 2.4700878e-10 2.5843131e-10 -1.527438e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.72e-05 1e-07 1.61e-05 ] [ 2.32e-05 4.23e-05 -3.26e-05 ] [ 2.86e-05 -3.39e-05 2.16e-05 ] [ -4.9e-05 -6.6e-06 -3.79e-05 ] [ -2e-05 -2e-06 3.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.755743787776e-14 1.6021766208e-16 2.579504359488e-14 ] [ 3.717049760256e-14 6.777207105984e-14 -5.223095783807999e-14 ] [ 4.582225135488e-14 -5.431378744512e-14 3.460701500928e-14 ] [ -7.85066544192e-14 -1.057436569728e-14 -6.072249392832e-14 ] [ -3.2043532416e-14 -3.2043532416e-15 5.271161082432e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.607069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.180092782941243e-18 } }