{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.9056242e-10 1.8006907e-10 5.397171000000001e-10 ] [ 1.2751122e-10 1.6872827e-10 3.6251749e-10 ] [ 1.7475908e-10 3.9909297e-10 2.9958475e-10 ] [ 3.6319474e-10 2.1912417e-10 3.0638331e-10 ] [ 4.092527300000001e-10 4.5401765e-10 2.4896678e-10 ] [ 3.4948658e-10 4.0954878e-10 4.8365957e-10 ] ] "source-value" [ [ 2.9056242 1.8006907 5.397171 ] [ 1.2751122 1.6872827 3.6251749 ] [ 1.7475908 3.9909297 2.9958475 ] [ 3.6319474 2.1912417 3.0638331 ] [ 4.0925273 4.5401765 2.4896678 ] [ 3.4948658 4.0954878 4.8365957 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.335810371208961e-12 -4.89929588874432e-12 4.519740247276801e-13 ] [ -6.1491538706304e-12 2.57565913559808e-12 3.42641492124288e-12 ] [ 1.13962823037504e-12 -1.09252423772352e-12 -5.532315871622399e-12 ] [ 2.74388768078208e-12 2.0443773681408e-12 1.0798670424192e-13 ] [ 1.6726723921152e-13 3.8500304197824e-13 1.1984281123584e-12 ] [ -2.2374396509472e-12 9.867805807507199e-13 3.4735189138944e-13 ] ] "source-value" [ [ 0.0027062 -0.0030579 0.0002821 ] [ -0.003838 0.0016076 0.0021386 ] [ 0.0007113 -0.0006819 -0.003453 ] [ 0.0017126 0.001276 6.74e-05 ] [ 0.0001044 0.0002403 0.000748 ] [ -0.0013965 0.0006159 0.0002168 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.88413821672536e-18 "source-value" -18.001375 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.236232871347692e-09 -4.735571542694375e-09 -1.265010246841972e-09 ] [ 2.364964258209128e-09 2.236184345564803e-09 1.580624301114661e-09 ] [ -9.24472540794924e-09 -3.111563022388706e-09 1.14409125356994e-09 ] [ 1.900600281237477e-09 -1.3225409005281e-08 -5.047644466199771e-09 ] [ 6.725698088931252e-09 7.759974714952603e-09 -5.990135758186393e-09 ] [ 1.489695650919074e-09 1.107638467006434e-08 9.578074916543535e-09 ] ] "source-value" [ [ -2.0198977 -2.9557113 -0.7895573 ] [ 1.4760946 1.3957165 0.9865481 ] [ -5.7701038 -1.9420849 0.7140856 ] [ 1.1862614 -8.2546511 -3.1504919 ] [ 4.1978506 4.8433953 -3.7387487 ] [ 0.9297949 6.9133356 5.9781642 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.29037075996857e-18 "source-value" -14.29537 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] "source-value" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] } "instance-id" 1 }