{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8932465 -2.7327553 0.11458 ] [ -1.7921017 0.7826803 0.4122751 ] [ -2.0334645 -1.814028 0.3682806 ] [ -3.0654312 1.6192958 6.4800964 ] [ 0.9149651 -0.8037323 -7.2142412 ] [ 2.2059949 1.8920802 -0.9808947 ] [ 1.876791 1.0564593 0.8199038 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.033315279711427e-09 -4.378356652027291e-09 1.83577397211264e-10 ] [ -2.871263445835935e-09 1.25399207822073e-09 6.605375265579821e-10 ] [ -3.257969281126762e-09 -2.906393251076583e-09 5.900505672141965e-10 ] [ -4.911362201310889e-09 2.594397872919633e-09 1.038225895261025e-08 ] [ 1.465935692067934e-09 -1.287721100441812e-09 -1.155848858745214e-08 ] [ 3.534393454384034e-09 3.031446661118588e-09 -1.57156655580663e-09 ] [ 3.006950662327853e-09 1.692634391286733e-09 1.313630699665079e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.114776 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.620565763182894e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.8970853 2.7035291 -0.3015519 ] [ 1.5750339 5.961529 1.0616352 ] [ 1.3867554 4.2209075 3.4847864 ] [ 5.3696851 1.9259021 1.1451061 ] [ 5.2716051 2.8121786 3.1595612 ] [ 2.5040067 4.4036081 -0.1864666 ] [ 3.5424235 3.9889697 3.8477684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.8970853e-10 2.7035291e-10 -3.015519e-11 ] [ 1.5750339e-10 5.961528999999999e-10 1.0616352e-10 ] [ 1.3867554e-10 4.2209075e-10 3.4847864e-10 ] [ 5.3696851e-10 1.9259021e-10 1.1451061e-10 ] [ 5.271605100000001e-10 2.8121786e-10 3.1595612e-10 ] [ 2.5040067e-10 4.4036081e-10 -1.864666e-11 ] [ 3.5424235e-10 3.9889697e-10 3.8477684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.3920445 -0.2502703 0.0900386 ] [ 0.0337304 -0.1054552 -0.1803058 ] [ -0.1522355 0.1241731 0.0809227 ] [ -0.200907 0.1340526 -0.3218094 ] [ 0.0608622 -0.0592428 0.0820307 ] [ -0.2198776 0.2066342 0.0417363 ] [ 0.086383 -0.0498916 0.2073869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.281245322132257e-10 -4.009772235406023e-10 1.442577398895629e-10 ] [ 5.404205829023232e-11 -1.689578559817882e-10 -2.888817373546406e-10 ] [ -2.439081589557984e-10 1.989472377522605e-10 1.296524580320122e-10 ] [ -3.218884983550656e-10 2.147759416774541e-10 -5.155954970336756e-10 ] [ 9.751199393045376e-11 -9.491742911073025e-11 1.314276697278586e-10 ] [ -3.522827501576141e-10 3.310644842977113e-10 6.686892409869504e-11 ] [ 1.384008230345664e-10 -7.993515509430528e-11 3.322704426401876e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.894153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.546524034401818e-18 } }