{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8899144 -4.6583421 -6.0684611 ] [ -5.6727783 -11.1023645 5.4490624 ] [ 0.025366 4.4963932 -2.3047552 ] [ -5.7562644 3.1807235 0.8745543 ] [ 1.9143579 -2.0889508 -0.1920944 ] [ -0.2615794 1.9441656 -1.8145679 ] [ 11.6408127 8.2283751 4.056262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.02797666699326e-09 -7.463486804308375e-09 -9.722746498654252e-09 ] [ -9.088792767241568e-09 -1.778794883749988e-08 8.730360382560338e-09 ] [ 4.06408121632128e-11 7.204016062964099e-09 -3.692624898107228e-09 ] [ -9.22255224482334e-09 5.096080828929149e-09 1.40119045308011e-09 ] [ 3.067139471223784e-09 -3.346868133761457e-09 -3.077691566666035e-10 ] [ -4.190963991628915e-10 3.114896671283605e-09 -2.907258266234152e-09 ] [ 1.865063795505173e-08 1.318331021239286e-08 6.498848144239451e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9973003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.601744081177683e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0371434 0.317564 3.2086183 ] [ 2.3678099 1.6523447 4.9659815 ] [ 3.2709877 4.7889828 3.1534591 ] [ 1.289505 3.845406 4.3785158 ] [ 3.8721001 1.3343351 1.3199189 ] [ 3.9917623 3.632837 1.2928721 ] [ 3.7158475 3.7309874 5.3895539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0371434e-10 3.17564e-11 3.2086183e-10 ] [ 2.3678099e-10 1.6523447e-10 4.9659815e-10 ] [ 3.2709877e-10 4.788982800000001e-10 3.1534591e-10 ] [ 1.289505e-10 3.845406e-10 4.3785158e-10 ] [ 3.8721001e-10 1.3343351e-10 1.3199189e-10 ] [ 3.9917623e-10 3.632837e-10 1.2928721e-10 ] [ 3.7158475e-10 3.7309874e-10 5.3895539e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -4e-07 -1e-07 ] [ -2.5e-06 -1.1e-06 1.2e-06 ] [ 1.9e-06 8e-07 -8e-07 ] [ -5e-07 -1e-06 -1.1e-06 ] [ -7e-07 8e-07 1.6e-06 ] [ -1e-06 9e-07 -7e-07 ] [ 1.5e-06 -1e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-15 -6.408706483200001e-16 -1.6021766208e-16 ] [ -4.005441552e-15 -1.76239428288e-15 1.92261194496e-15 ] [ 3.04413557952e-15 1.28174129664e-15 -1.28174129664e-15 ] [ -8.010883104e-16 -1.6021766208e-15 -1.76239428288e-15 ] [ -1.12152363456e-15 1.28174129664e-15 2.56348259328e-15 ] [ -1.6021766208e-15 1.44195895872e-15 -1.12152363456e-15 ] [ 2.4032649312e-15 -1.6021766208e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.795367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.851132096595583e-18 } }