{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.468554 0.0062453 1.779472 ] [ 0.0137549 1.819656 0.3703857 ] [ 0.6368997 2.724291 2.946976 ] [ 2.361208 0.5254432 0.0878272 ] [ 1.952332 1.317185 1.267695 ] [ 2.764287 2.133831 2.76552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.685540000000001e-11 6.2453e-13 1.779472e-10 ] [ 1.37549e-12 1.819656e-10 3.703857e-11 ] [ 6.368997e-11 2.724291e-10 2.946976e-10 ] [ 2.361208e-10 5.254432e-11 8.782719999999999e-12 ] [ 1.952332e-10 1.317185e-10 1.267695e-10 ] [ 2.764287e-10 2.133831e-10 2.76552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.7577732 -27.8022493 11.9705827 ] [ -24.5504027 12.7025176 -20.0008035 ] [ -16.1201568 17.7751368 17.9292565 ] [ -10.3255759 40.1212075 56.2004299 ] [ 44.7101126 -50.7047237 -82.92494 ] [ 24.0437959 7.908111 16.8254744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.84510890585088e-08 -4.454411383411316e-08 1.917898773929294e-08 ] [ -3.93340812371652e-08 2.035167672402053e-08 -3.204481976491482e-08 ] [ -2.582733834859014e-08 2.847890861248172e-08 2.872583559262644e-08 ] [ -1.654339630327592e-08 6.428126065476561e-08 9.004301486468928e-08 ] [ 7.163349712105551e-08 -8.123792287626368e-08 -1.328604001492428e-07 ] [ 3.852240766626689e-08 1.267019055889131e-08 2.695738171754891e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 303.23384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.858341690834079e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3462575 -0.1847199 1.8619865 ] [ -0.1550486 1.907018 0.2331721 ] [ 0.5263212 2.8462229 3.0699548 ] [ 2.2749159 0.8847464 0.5854006 ] [ 2.2749159 0.8847464 0.5854006 ] [ 2.9296736 2.1886376 2.8819612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.462575e-11 -1.847199e-11 1.8619865e-10 ] [ -1.550486e-11 1.907018e-10 2.331721e-11 ] [ 5.263212000000001e-11 2.8462229e-10 3.0699548e-10 ] [ 2.2749159e-10 8.847464000000001e-11 5.854006000000001e-11 ] [ 2.2749159e-10 8.847464000000001e-11 5.854006000000001e-11 ] [ 2.9296736e-10 2.1886376e-10 2.8819612e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -15.0909531 -20.3888545 10.8225473 ] [ -19.5852647 10.2068231 -13.8804342 ] [ -11.3240996 12.801755 12.9073028 ] [ 14.1553738 -1.130460403551102e+114 -1.130460403551102e+114 ] [ 14.1553738 1.130460403551102e+114 1.130460403551102e+114 ] [ 17.6895698 7.3848469 15.0240253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.417837224240929e-08 -3.266654600479287e-08 1.733963226156217e-08 ] [ -3.137905321451952e-08 1.635313334346138e-08 -2.223890716179275e-08 ] [ -1.814320763073063e-08 2.05106725662095e-08 2.067977878374638e-08 ] [ 2.267940896104485e-08 -1.811197229309709e+105 -1.811197229309709e+105 ] [ 2.267940896104485e-08 1.811197229309709e+105 1.811197229309709e+105 ] [ 2.834181516556974e-08 1.183182905136736e-08 2.407114208596771e-08 ] ] } "relaxed-potential-energy" { "source-value" -4.1835439e+97 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.702776228670454e+78 } }