{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6087006 6.3189293 -0.7759724 ] [ -7.7690089 3.8311754 10.3540191 ] [ -0.4873249 -5.2166637 0.0536075 ] [ 1.1006631 6.0746328 -11.2709759 ] [ 8.5666451 -5.5834034 -3.4533337 ] [ 6.8687623 -4.0773775 1.9447669 ] [ 0.328964 -1.3472928 3.1478884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.379265883678693e-08 1.012404079294811e-08 -1.243244837666066e-09 ] [ -1.244732442636712e-08 6.138219656064088e-09 1.658896733333666e-08 ] [ -7.807805615136979e-10 -8.358016618716025e-09 8.5888683199536e-11 ] [ 1.763456686197253e-09 9.732634652104843e-09 -1.805809408058024e-08 ] [ 1.372527849791088e-08 -8.945598391975232e-09 -5.532850517960761e-09 ] [ 1.100497037089244e-08 -6.532678904675952e-09 3.115860060085692e-09 ] [ 5.270584298848512e-10 -2.15860102553217e-09 5.043473199367519e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.959135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.275194001879101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7532478 4.5524255 2.5467552 ] [ 5.7922784 3.4588181 0.9938195 ] [ 2.0542062 2.4603178 2.6040781 ] [ 6.3647245 3.0248223 3.0847785 ] [ 4.0003311 4.718594 0.7206407 ] [ 5.446895 4.0452578 4.8087831 ] [ 3.5968569 5.1990745 4.4872999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7532478e-10 4.5524255e-10 2.5467552e-10 ] [ 5.7922784e-10 3.4588181e-10 9.938195e-11 ] [ 2.0542062e-10 2.4603178e-10 2.6040781e-10 ] [ 6.3647245e-10 3.0248223e-10 3.0847785e-10 ] [ 4.000331100000001e-10 4.718594000000001e-10 7.206407e-11 ] [ 5.446895e-10 4.0452578e-10 4.8087831e-10 ] [ 3.5968569e-10 5.1990745e-10 4.4872999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0945007 0.0766464 -0.2917869 ] [ 0.2534778 -0.0203025 0.6579849 ] [ -0.4428734 -0.1073597 0.0031948 ] [ 0.1032965 0.0991294 -0.8120167 ] [ -0.0772089 -0.1137351 0.2199873 ] [ 0.2887795 -0.0512805 0.2577913 ] [ -0.2199722 0.1169019 -0.0351548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.514068121892346e-10 1.228010701484851e-10 -4.674941494357075e-10 ] [ 4.061162050518182e-10 -3.2528190843792e-11 1.054208023619426e-09 ] [ -7.095614074542067e-10 -1.720092013561018e-10 5.11863386813184e-12 ] [ 1.654992373104672e-10 1.588228071139315e-10 -1.300994172439167e-09 ] [ -1.237022944976851e-10 -1.822237181843501e-10 3.524585089329158e-10 ] [ 4.626757634663137e-10 -8.21604182029344e-11 4.13027193905639e-10 ] [ -3.524343160659418e-10 1.872974911070995e-10 -5.632419866889984e-11 ] ] } "relaxed-potential-energy" { "source-value" -16.202629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.595947337929609e-18 } }