{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0932566 1.5984577 -1.306183 ] [ -3.2375563 8.1946136 0.5910669 ] [ 0.1266755 0.0552093 1.8867875 ] [ -0.8660934 -2.0074347 -0.2691759 ] [ 5.0702308 -7.840846 -0.9024954 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.751590165055297e-09 2.56101155627774e-09 -2.092735865086406e-09 ] [ -5.187137012383752e-09 1.312921832640972e-08 9.469935685087315e-10 ] [ 2.029565245281504e-10 8.845504971073344e-11 3.02296682091768e-09 ] [ -1.387634596909183e-09 -3.216264944122662e-09 -4.312673338627988e-10 ] [ 8.12340524982008e-09 -1.25624201484932e-08 -1.445957030259544e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2231282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.368373889481186e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6288046 2.7048615 0.9695868 ] [ 4.6430278 0.7616959 4.2508485 ] [ 5.0828273 4.2591435 2.2288016 ] [ 3.2748305 4.1664779 0.9755209 ] [ 5.5639018 2.6776502 3.6853153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6288046e-10 2.7048615e-10 9.695868e-11 ] [ 4.6430278e-10 7.616959e-11 4.2508485e-10 ] [ 5.0828273e-10 4.259143500000001e-10 2.2288016e-10 ] [ 3.2748305e-10 4.1664779e-10 9.755209e-11 ] [ 5.563901800000001e-10 2.6776502e-10 3.6853153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1230783 0.1373692 -0.2037289 ] [ 0.0861605 -0.1799332 0.1907727 ] [ 0.0680345 -0.1208796 0.1203584 ] [ -0.0994005 -0.0471329 0.0064997 ] [ 0.0682839 0.2105765 -0.1139019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.971931747878087e-10 2.200897206579994e-10 -3.264096805613011e-10 ] [ 1.380443387364384e-10 -2.882847663457305e-10 3.056515598268922e-10 ] [ 1.090032853078176e-10 -1.936704690516557e-10 1.928354145968948e-10 ] [ -1.592571571958304e-10 -7.551523045050431e-11 1.041366738221376e-11 ] [ 1.094028681570451e-10 3.373807451898912e-10 -1.824909612446995e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.680912 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.711270749522217e-18 } }