{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.9689915 12.9344954 3.1898693 ] [ 9.2000542 -13.8422624 5.0068833 ] [ 2.81802 8.2211556 -9.2663507 ] [ 5.148045 -10.1914675 -7.418925 ] [ 7.2329851 1.5745419 5.9220691 ] [ -5.9901783 2.1015319 -6.2806916 ] [ 1.5600654 -0.7979949 8.8471457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.199385158584461e-08 2.072334630246048e-08 5.110734057973935e-09 ] [ 1.474011187077356e-08 -2.217774937897676e-08 8.021911432424812e-09 ] [ 4.51496579814468e-09 1.317174340679825e-08 -1.484633057398954e-08 ] [ 8.24807740978053e-09 -1.632853109467039e-08 -1.188642828439845e-08 ] [ 1.158851972129015e-08 2.522694241433965e-09 9.488200736953409e-09 ] [ -9.59732370575384e-09 3.367025305785624e-09 -1.006277732688007e-08 ] [ 2.499500331391863e-09 -1.278528782831166e-09 1.417469011813357e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.950924 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.715837435750982e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5783947 2.4049428 3.5999579 ] [ 1.5397626 4.5433923 3.1233085 ] [ 2.921345 3.6335873 1.350606 ] [ 4.6986936 2.1730435 2.3101925 ] [ 4.6242006 2.7692013 4.8773478 ] [ 5.1441321 4.6312763 1.4676977 ] [ 6.2673904 3.9032045 3.4943044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5783947e-10 2.4049428e-10 3.5999579e-10 ] [ 1.5397626e-10 4.5433923e-10 3.1233085e-10 ] [ 2.921345e-10 3.6335873e-10 1.350606e-10 ] [ 4.698693600000001e-10 2.1730435e-10 2.3101925e-10 ] [ 4.6242006e-10 2.7692013e-10 4.8773478e-10 ] [ 5.1441321e-10 4.6312763e-10 1.4676977e-10 ] [ 6.2673904e-10 3.9032045e-10 3.4943044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.57e-05 -1.39e-05 -1.83e-05 ] [ -8.39e-05 0.0001158 -5.04e-05 ] [ 0.0001236 -8.8e-05 2.39e-05 ] [ 8.1e-06 0.0001425 -1.76e-05 ] [ 9.77e-05 -2.23e-05 2.62e-05 ] [ -9.64e-05 -6.07e-05 0.0001075 ] [ -7.49e-05 -7.34e-05 -7.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.11759394938e-14 -2.22702552126e-14 -2.93198324022e-14 ] [ -1.344226195926e-13 1.855320542172e-13 -8.074970235359998e-14 ] [ 1.980290319624e-13 -1.40991543792e-13 3.82920215526e-14 ] [ 1.29776307354e-14 2.28310170345e-13 -2.81983087584e-14 ] [ 1.565326571418e-13 -3.572853893819999e-14 4.197702781079999e-14 ] [ -1.544498275176e-13 -9.725212168379999e-14 1.72233988155e-13 ] [ -1.200030298866e-13 -1.175997649356e-13 -1.140749763408e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.900176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.989448016968758e-18 } }