{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.4681425 -68.0692196 -17.3954003 ] [ -37.5679275 12.7570869 53.0803308 ] [ -22.889013 14.1896106 -31.0344852 ] [ -8.0213487 15.6779824 0.4407 ] [ 39.545411 11.3189787 -50.6346398 ] [ 45.4010207 14.1255611 45.5434945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.638487290150286e-08 -1.090589122392211e-07 -2.78705036701173e-08 ] [ -6.01904551324094e-08 2.043910638069395e-08 8.504406503209016e-08 ] [ -3.667224150178727e-08 2.273426236157586e-08 -4.972272662600361e-08 ] [ -1.285161735442447e-08 2.511889686259387e-08 7.0607923678656e-10 ] [ 6.335873296412715e-08 1.813500304447318e-08 -8.112563609018918e-08 ] [ 7.274045392599684e-08 2.263164375010193e-08 7.296872211743338e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.666386 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.034820303922844e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.221499 -0.1148703 1.2726887 ] [ 0.7284458 1.5053718 3.1969506 ] [ 0.5958074 1.8374595 -0.2661362 ] [ -0.3306299 2.9356331 1.6246623 ] [ 3.0428344 1.3393447 0.0725344 ] [ 3.13908 1.0983803 2.5854276 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.221499e-10 -1.148703e-11 1.2726887e-10 ] [ 7.284458000000001e-11 1.5053718e-10 3.1969506e-10 ] [ 5.958074e-11 1.8374595e-10 -2.661362e-11 ] [ -3.306299e-11 2.9356331e-10 1.6246623e-10 ] [ 3.0428344e-10 1.3393447e-10 7.25344e-12 ] [ 3.13908e-10 1.0983803e-10 2.5854276e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.29e-05 1.6e-06 7.1e-06 ] [ 9.7e-06 -8.4e-06 3.4e-06 ] [ -7.1e-06 7.2e-06 3.2e-06 ] [ 1.5e-06 -5.9e-06 -1.65e-05 ] [ 5.7e-06 5.3e-06 -1.9e-06 ] [ 3.2e-06 0.0 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.066807840832e-14 2.56348259328e-15 1.137545400768e-14 ] [ 1.554111322176e-14 -1.345828361472e-14 5.44740051072e-15 ] [ -1.137545400768e-14 1.153567166976e-14 5.126965186560001e-15 ] [ 2.4032649312e-15 -9.45284206272e-15 -2.64359142432e-14 ] [ 9.13240673856e-15 8.491536090240001e-15 -3.04413557952e-15 ] [ 5.126965186560001e-15 0.0 7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.047461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250651359579979e-18 } }