{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5644111 -0.1358757 -0.809496 ] [ 0.3477978 0.5745888 0.0551571 ] [ -3.2105137 1.2874473 -0.0527958 ] [ -1.4478985 -1.8539884 -1.3952032 ] [ 1.9789875 -2.7439979 2.4900055 ] [ -0.2386693 0.7853827 -1.1208966 ] [ 2.0058851 2.0864433 0.8332289 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.042862763902374e-10 -2.176968716683937e-10 -1.296955576516464e-09 ] [ 5.572335085166051e-10 9.205927495180991e-10 8.83714168192014e-11 ] [ -5.143810033276886e-09 2.062717981566388e-09 -8.458819713333719e-11 ] [ -2.319789145103649e-09 -2.970416894187045e-09 -2.235361966722029e-09 ] [ 3.170687531478074e-09 -4.396369319125068e-09 3.989428630631487e-09 ] [ -3.823903757131362e-10 1.258321810687832e-09 -1.795874341650044e-09 ] [ 3.213782237708753e-09 3.342850703425852e-09 1.334979874353522e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.459726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.156485849724228e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1960787 1.4414001 2.8140314 ] [ 1.9990127 3.6477792 1.3486234 ] [ 2.2322838 3.6634276 3.685731 ] [ 3.2921944 1.4316606 1.6220918 ] [ 4.0277851 1.9278952 3.804483 ] [ 4.4578528 3.5338033 1.2759146 ] [ 4.6110304 4.299476 4.0840769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1960787e-10 1.4414001e-10 2.8140314e-10 ] [ 1.9990127e-10 3.6477792e-10 1.3486234e-10 ] [ 2.2322838e-10 3.6634276e-10 3.685731e-10 ] [ 3.2921944e-10 1.4316606e-10 1.6220918e-10 ] [ 4.0277851e-10 1.9278952e-10 3.804483e-10 ] [ 4.4578528e-10 3.5338033e-10 1.2759146e-10 ] [ 4.6110304e-10 4.299476000000001e-10 4.0840769e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1952831 -0.1518368 -0.5974823 ] [ 0.2367924 0.5322539 0.0077096 ] [ -0.2454882 0.1848318 0.2173774 ] [ -0.1786078 -0.4418142 0.1733539 ] [ 0.366643 -0.3427301 0.7343687 ] [ -0.5132661 -0.0535935 -0.8772936 ] [ 0.1386436 0.2728888 0.3419664 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.128780198350853e-10 -2.432693731413311e-10 -9.57272180288578e-10 ] [ 3.793832503887815e-10 8.527647619353724e-10 1.23521409774864e-11 ] [ -3.933154579627187e-10 2.961331911801612e-10 3.482769910396716e-10 ] [ -2.861612438101452e-10 -7.078643878094027e-10 2.777435679927726e-10 ] [ 5.874268476196619e-10 -5.491141579884833e-10 1.176588371880956e-09 ] [ -8.223429524443072e-10 -8.5866253434279e-11 -1.405579307077742e-09 ] [ 2.221315363736424e-10 4.372160590402992e-10 5.478905756930976e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.353276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.299648342855298e-18 } }