{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.462385 1.450975 0.2684659 ] [ 3.060126 2.637643 2.086081 ] [ 2.184778 3.8492 0.5676389 ] [ 4.510071 4.418515 1.324556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.462385e-10 1.450975e-10 2.684659e-11 ] [ 3.060126e-10 2.637643e-10 2.086081e-10 ] [ 2.184778e-10 3.849200000000001e-10 5.676389e-11 ] [ 4.510071e-10 4.418515e-10 1.324556e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1228759 -8.9675774 -5.3109912 ] [ 2.8454569 -5.2465678 12.2465881 ] [ -8.4013429 9.8577781 -7.1360906 ] [ 6.6787619 4.3563671 0.2004937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.799045515039759e-09 -1.436764285549445e-08 -8.509145933914538e-09 ] [ 4.558924520674043e-09 -8.405928268602091e-09 1.96211971383875e-08 ] [ -1.346043517770407e-08 1.579390160485425e-08 -1.143327752323064e-08 ] [ 1.070055617206979e-08 6.979669519242296e-09 3.21226318757689e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 1.2662279 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.028720737984681e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1234669 1.7315882 0.549613 ] [ 3.7749471 2.1284369 2.2983829 ] [ 2.3337306 4.0497304 -0.17501 ] [ 3.9852155 4.4465775 1.5737559 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1234669e-10 1.7315882e-10 5.49613e-11 ] [ 3.7749471e-10 2.1284369e-10 2.2983829e-10 ] [ 2.3337306e-10 4.0497304e-10 -1.7501e-11 ] [ 3.9852155e-10 4.4465775e-10 1.5737559e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 0.0 1e-06 ] [ 2.5e-06 -2e-07 -2.3e-06 ] [ 2.4e-06 -2e-06 -1.7e-06 ] [ -1.2e-06 2.1e-06 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 0.0 1.6021766208e-15 ] [ 4.005441552e-15 -3.2043532416e-16 -3.68500622784e-15 ] [ 3.84522388992e-15 -3.2043532416e-15 -2.72370025536e-15 ] [ -1.92261194496e-15 3.36457090368e-15 4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.5906962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.21616359872354e-18 } }