{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.8254981 8.8019272 -0.2720619 ] [ 2.5798439 -6.977361 1.3226796 ] [ -0.3198372 -4.1424872 -11.8581716 ] [ 8.5654914 2.317921 10.807554 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73443601072314e-08 1.410224209400904e-08 -4.358912191816446e-10 ] [ 4.133365615947432e-09 -1.117896476118287e-08 2.119166349388466e-09 ] [ -5.124356885239848e-10 -6.636996198484083e-09 -1.899888545948239e-08 ] [ 1.372343017980795e-08 3.713718865657914e-09 1.731561048949323e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0492571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.089801744678601e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8596331 5.0437704 2.7609431 ] [ 4.937541 2.0841487 3.0008726 ] [ 3.3475857 3.0436675 1.2349078 ] [ 4.4496082 4.0842615 4.5268995 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8596331e-10 5.0437704e-10 2.7609431e-10 ] [ 4.937541e-10 2.0841487e-10 3.0008726e-10 ] [ 3.3475857e-10 3.043667500000001e-10 1.2349078e-10 ] [ 4.4496082e-10 4.0842615e-10 4.5268995e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 -1.76e-05 -8.2e-06 ] [ 3e-06 1.06e-05 1.24e-05 ] [ -1.17e-05 1.54e-05 3.1e-06 ] [ -1.6e-06 -8.4e-06 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.66626369936e-14 -2.81983087584e-14 -1.31378483988e-14 ] [ 4.806529901999999e-15 1.69830723204e-14 1.98669902616e-14 ] [ -1.87454666178e-14 2.46735201636e-14 4.9667475654e-15 ] [ -2.5634826144e-15 -1.34582837256e-14 -1.15356717648e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.704511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.715051740259597e-18 } }