{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.7713298e-10 -2.4742875e-10 -4.047138000000001e-11 ] [ 5.286361000000001e-11 -7.586834e-11 9.1781547e-10 ] [ -3.7248291e-10 6.7521102e-10 2.9205432e-10 ] [ 7.8218137e-10 -8.564081e-11 -2.7185864e-10 ] [ 1.02211623e-09 2.565587e-11 6.925291600000001e-10 ] [ 4.9093454e-10 8.663708800000001e-10 -1.7764349e-10 ] [ 4.588701300000001e-10 8.4169433e-10 8.2227525e-10 ] ] "source-value" [ [ -1.7713298 -2.4742875 -0.4047138 ] [ 0.5286361 -0.7586834 9.1781547 ] [ -3.7248291 6.7521102 2.9205432 ] [ 7.8218137 -0.8564081 -2.7185864 ] [ 10.2211623 0.2565587 6.9252916 ] [ 4.9093454 8.6637088 -1.7764349 ] [ 4.5887013 8.4169433 8.2227525 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.6021766208e-16 -4.8065298624e-16 -1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ -6.408706483200001e-16 3.2043532416e-16 -1.6021766208e-16 ] [ 3.2043532416e-16 0.0 -3.2043532416e-16 ] [ 4.8065298624e-16 -4.8065298624e-16 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 3.2043532416e-16 6.408706483200001e-16 4.8065298624e-16 ] ] "source-value" [ [ -1e-07 -3e-07 -1e-07 ] [ 0.0 0.0 0.0 ] [ -4e-07 2e-07 -1e-07 ] [ 2e-07 0.0 -2e-07 ] [ 3e-07 -3e-07 1e-07 ] [ 0.0 0.0 0.0 ] [ 2e-07 4e-07 3e-07 ] ] } "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" 5.687805670712082e-31 "source-value" 3.5500491e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.970406523800384e-08 -2.083015010918559e-08 -1.446800015488578e-08 ] [ -9.709060705959377e-09 -1.647818178675586e-08 2.562416761304779e-08 ] [ -2.850961657046663e-08 1.513128381217182e-08 -3.042690896861024e-09 ] [ 1.669971362659024e-08 -1.15746279534241e-08 -2.236489704406961e-08 ] [ 2.622907083818979e-08 -1.026129445752218e-08 1.380809773114029e-08 ] [ 8.154282718091461e-09 2.107108478855085e-08 -2.072393493163329e-08 ] [ 6.839675491776005e-09 2.294188570616508e-08 2.116725768326163e-08 ] ] "source-value" [ [ -12.2983103 -13.0011572 -9.0302155 ] [ -6.0599191 -10.2848722 15.9933476 ] [ -17.7943032 9.4442046 -1.8990983 ] [ 10.4231415 -7.2243146 -13.9590709 ] [ 16.3708985 -6.4045963 8.6183368 ] [ 5.089503 13.1515368 -12.9348629 ] [ 4.2689897 14.3191989 13.2115632 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.393821221544019e-17 "source-value" 149.41057 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] "source-value" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] } "instance-id" 1 }