{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9296977 -0.9683681 -2.0926065 ] [ -3.0092064 0.3565363 10.5617811 ] [ -4.4511605 2.7645959 -2.9118435 ] [ -1.5262251 -10.0752134 -3.7278797 ] [ 4.4683859 -0.7848857 -7.9792509 ] [ -3.6124391 6.0288557 1.3016944 ] [ 12.0603428 2.6784793 4.8481051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.296069833623542e-09 -1.551496742930975e-09 -3.352725238456521e-09 ] [ -4.821280180963257e-09 5.712341290328141e-10 1.692183889184282e-08 ] [ -7.131545347283757e-09 4.429370953432201e-09 -4.665287617564778e-09 ] [ -2.445282193444313e-09 -1.61422714920437e-08 -5.972721749702929e-09 ] [ 7.159143480675061e-09 -1.257525528900734e-09 -1.278416934880347e-08 ] [ -5.787765517767989e-09 9.659291732297713e-09 2.085544352288649e-09 ] [ 1.932279943219014e-08 4.291396949112675e-09 7.767520710396232e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.599442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.698217830583823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9306979 2.6238129 1.4817292 ] [ 2.6405811 2.988389 5.0284904 ] [ 1.0476636 3.6468636 3.4880722 ] [ 3.2061976 1.4848523 3.1941061 ] [ 4.2086279 3.3074268 1.574104 ] [ 3.1631902 4.8944151 3.0845391 ] [ 4.8038737 3.2306464 3.973376 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9306979e-10 2.6238129e-10 1.4817292e-10 ] [ 2.6405811e-10 2.988389e-10 5.0284904e-10 ] [ 1.0476636e-10 3.6468636e-10 3.4880722e-10 ] [ 3.2061976e-10 1.4848523e-10 3.1941061e-10 ] [ 4.2086279e-10 3.3074268e-10 1.574104e-10 ] [ 3.1631902e-10 4.8944151e-10 3.084539100000001e-10 ] [ 4.8038737e-10 3.2306464e-10 3.973376e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.6315959 -0.8057219 -0.3774048 ] [ -0.3657233 -0.6389541 2.0421301 ] [ -0.7479327 1.2509728 -0.7886066 ] [ -0.0744658 -1.2312837 -0.2468716 ] [ 0.7560079 0.2729774 -1.3593747 ] [ -0.6882287 0.9748665 0.259458 ] [ 1.7519386 0.1771431 0.4706697 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.011928193110201e-09 -1.290908801682084e-09 -6.046691521194431e-10 ] [ -5.85953325769372e-10 -1.023717329218499e-09 3.271853129808083e-09 ] [ -1.198320295744532e-09 2.004279389929555e-09 -1.263487067938184e-09 ] [ -1.193073647921172e-10 -1.972733973965066e-09 -3.955319091181944e-10 ] [ 1.211258192499409e-09 4.373580118900715e-10 -2.17795838119076e-09 ] [ -1.102663941988196e-09 1.561908327569361e-09 4.15697545104372e-10 ] [ 2.806915089122672e-09 2.838145356943253e-10 7.540959956717897e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.713428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.677786381564135e-18 } }