{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.4070378 -0.4708511 7.3256217 ] [ -14.5684978 3.8725948 -6.4432592 ] [ 7.5971022 -9.6861573 -8.7257374 ] [ 9.5005783 -10.1848494 13.6968104 ] [ 8.8778552 16.469263 -5.8534354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.827608927574186e-08 -7.543866242979629e-10 1.173693982056515e-08 ] [ -2.334130657533623e-08 6.204580850391652e-09 -1.032323925199451e-08 ] [ 1.217189953066825e-08 -1.551893477145125e-08 -1.398017246152018e-08 ] [ 1.522160443633981e-08 -1.631792759504891e-08 2.19447094024103e-08 ] [ 1.422389204428771e-08 2.638666814040647e-08 -9.378237349243097e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.94164157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.508676108627407e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1632095 1.2089311 2.9945783 ] [ 0.1864784 1.8337991 0.7045539 ] [ 2.2427683 0.3536688 0.2735582 ] [ 2.215433 0.9975994 2.7614254 ] [ 2.5342703 2.8377335 0.9958868 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.632095e-11 1.2089311e-10 2.9945783e-10 ] [ 1.864784e-11 1.8337991e-10 7.045539e-11 ] [ 2.2427683e-10 3.536688e-11 2.735582e-11 ] [ 2.215433e-10 9.975994e-11 2.7614254e-10 ] [ 2.5342703e-10 2.8377335e-10 9.958868e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 -4.1e-06 1.68e-05 ] [ 8.7e-06 6.2e-06 -2.7e-06 ] [ 7.9e-06 -5.7e-06 -6e-06 ] [ -8e-06 2e-06 -4e-06 ] [ -1.8e-06 1.6e-06 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089480102144e-14 -6.568924145279999e-15 2.691656722944e-14 ] [ 1.393893660096e-14 9.93349504896e-15 -4.32587687616e-15 ] [ 1.265719530432e-14 -9.13240673856e-15 -9.6130597248e-15 ] [ -1.28174129664e-14 3.2043532416e-15 -6.4087064832e-15 ] [ -2.88391791744e-15 2.56348259328e-15 -6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363098921002e-18 } }