{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0912932 -1.2357228 0.4677873 ] [ 1.2009346 -1.8889947 -0.1592342 ] [ 2.4929217 -2.3033 -2.9482185 ] [ 1.8824224 1.0395576 5.0829393 ] [ -2.4849856 4.3884599 -2.4432739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.952797693078019e-09 -1.979846179949514e-09 7.494778755671559e-10 ] [ 1.9241093392298e-09 -3.02650314515511e-09 -2.551213124717913e-10 ] [ 3.994100865224992e-09 -3.69029341068864e-09 -4.723566753710045e-09 ] [ 3.015973159750226e-09 1.665554882694958e-09 8.143766511405517e-09 ] [ -3.981385831344661e-09 7.031087853098306e-09 -3.914556320790837e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9903086 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.280188563189718e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7107901 -0.1825452 1.772057 ] [ 0.1927607 2.1176256 1.8910031 ] [ 2.3562456 0.2723667 0.141463 ] [ 2.4938675 1.4029186 2.3048113 ] [ 1.8383248 2.5725617 0.2605296 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.107901e-11 -1.825452e-11 1.772057e-10 ] [ 1.927607e-11 2.1176256e-10 1.8910031e-10 ] [ 2.3562456e-10 2.723667e-11 1.41463e-11 ] [ 2.4938675e-10 1.4029186e-10 2.3048113e-10 ] [ 1.8383248e-10 2.5725617e-10 2.605296e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.97e-05 -2.65e-05 -2.85e-05 ] [ -1.86e-05 3.34e-05 4e-05 ] [ 2.56e-05 8e-06 1.57e-05 ] [ 2.19e-05 -1.1e-06 1.1e-05 ] [ -9.3e-06 -1.39e-05 -3.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.156287942976e-14 -4.24576804512e-14 -4.56620336928e-14 ] [ -2.980048514688e-14 5.351269913472e-14 6.4087064832e-14 ] [ 4.101572149248001e-14 1.28174129664e-14 2.515417294656e-14 ] [ 3.508766799552e-14 -1.76239428288e-15 1.76239428288e-14 ] [ -1.490024257344e-14 -2.227025502912e-14 -6.120314691456e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }