{ "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" [ [ 1.492003 2.387549 2.170669 ] [ 2.788135 3.420279 0.7006935 ] [ 2.516882 3.82705 3.771673 ] [ 3.610971 1.743132 2.445693 ] [ 4.42605 4.234183 2.406002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.492003e-10 2.387549e-10 2.170669e-10 ] [ 2.788135e-10 3.420279e-10 7.006935e-11 ] [ 2.516882e-10 3.82705e-10 3.771673e-10 ] [ 3.610971e-10 1.743132e-10 2.445693e-10 ] [ 4.42605e-10 4.234183e-10 2.406002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4202069 -0.1090987 1.3100948 ] [ 1.8634973 1.2202122 -1.3194879 ] [ 0.1351212 -0.0708542 0.228837 ] [ 1.7073559 -0.2302061 0.2900655 ] [ -1.2857675 -0.8100531 -0.5095095 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.877598912678844e-09 -1.74795386499673e-10 2.099003259591652e-09 ] [ 2.985651806983924e-09 1.954995459254934e-09 -2.114052664808488e-09 ] [ 2.16488027614441e-10 -1.135209427254874e-10 3.666372913740096e-10 ] [ 2.735485706364943e-09 -3.688308313855468e-10 4.647361626006624e-10 ] [ -2.060026628284464e-09 -1.297848138426565e-09 -8.163242089754976e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.696452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03419585615094e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4973802 2.4644549 2.234217 ] [ 2.8548108 3.4716977 0.57969 ] [ 2.458301 3.8648273 3.8708904 ] [ 3.7533257 1.7442337 2.4352526 ] [ 4.2702234 4.0669795 2.3746806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4973802e-10 2.4644549e-10 2.234217e-10 ] [ 2.8548108e-10 3.4716977e-10 5.796900000000001e-11 ] [ 2.458301e-10 3.8648273e-10 3.8708904e-10 ] [ 3.7533257e-10 1.7442337e-10 2.4352526e-10 ] [ 4.2702234e-10 4.066979500000001e-10 2.3746806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0878338 -0.0198696 0.0438528 ] [ -0.0525749 0.0502862 0.0026607 ] [ -0.0970738 0.1660097 -0.0092105 ] [ 0.0783493 -0.0871671 -0.0971395 ] [ -0.0165343 -0.1092593 0.0598365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.407252608760231e-10 -3.183460858464768e-11 7.025993091661825e-11 ] [ -8.423427562089793e-11 8.056737398887297e-11 4.26291133496256e-12 ] [ -1.555293728522151e-10 2.659768601660218e-10 -1.47568477658784e-11 ] [ 1.255294167160454e-10 -1.396570897229357e-10 -1.556346358562016e-10 ] [ -2.649086890129344e-11 -1.750526960649734e-10 9.586864137049921e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.866221 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2216135105046e-18 } }