{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4195924 0.6572249 -3.98085 ] [ -5.0522364 3.73245 2.4519092 ] [ -4.0100565 -3.6893799 1.0515085 ] [ 1.0460965 -3.3268854 -1.808795 ] [ 0.9808004 0.1454542 -0.6900937 ] [ 5.4667225 -1.995136 3.0759221 ] [ 2.9882659 4.4762724 -0.0996011 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.274437754345362e-09 1.052990369387618e-09 -6.378024800911681e-09 ] [ -8.094575042834758e-09 5.98004412830496e-09 3.928391596564431e-09 ] [ -6.424818772387076e-09 -5.911038221029442e-09 1.684702335272477e-09 ] [ 1.676031355400707e-09 -5.330258007960856e-09 -2.898009060819936e-09 ] [ 1.571415470551288e-09 2.330433186371674e-10 -1.105651992301369e-09 ] [ 8.75865498190133e-09 -3.196560254516429e-09 4.92817047602204e-09 ] [ 4.78772976171387e-09 7.171778987612306e-09 -1.595785538259629e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3499651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.177594224691594e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1309087 2.8240284 1.44979 ] [ 1.9278373 2.9361944 3.8307786 ] [ 1.9190271 0.5767364 3.985322 ] [ 4.0742742 0.090596 3.1429552 ] [ 4.3784672 2.0660265 1.7598754 ] [ 5.0975311 1.2643505 4.9590418 ] [ 4.3269604 3.3008774 3.9685889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1309087e-10 2.8240284e-10 1.44979e-10 ] [ 1.9278373e-10 2.936194400000001e-10 3.8307786e-10 ] [ 1.9190271e-10 5.767364000000001e-11 3.985322e-10 ] [ 4.0742742e-10 9.0596e-12 3.1429552e-10 ] [ 4.378467200000001e-10 2.0660265e-10 1.7598754e-10 ] [ 5.0975311e-10 1.2643505e-10 4.9590418e-10 ] [ 4.3269604e-10 3.3008774e-10 3.9685889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -7.8e-06 6.8e-06 ] [ 5.1e-06 3.8e-06 -6.3e-06 ] [ -7.4e-06 2.2e-06 -1e-06 ] [ 2.4e-06 -1.3e-06 -3e-07 ] [ -5.3e-06 6.6e-06 2.3e-06 ] [ 8.7e-06 -8.3e-06 1.1e-06 ] [ -9e-06 4.8e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -1.249697764224e-14 1.089480102144e-14 ] [ 8.17110076608e-15 6.08827115904e-15 -1.009371271104e-14 ] [ -1.185610699392e-14 3.52478856576e-15 -1.6021766208e-15 ] [ 3.84522388992e-15 -2.08282960704e-15 -4.8065298624e-16 ] [ -8.491536090240001e-15 1.057436569728e-14 3.68500622784e-15 ] [ 1.393893660096e-14 -1.329806595264e-14 1.76239428288e-15 ] [ -1.44195895872e-14 7.69044777984e-15 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }