{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8556486 -0.100515 -0.5283443 ] [ 1.6657501 2.1082057 -0.9866755 ] [ -0.6733068 1.188336 -0.5363405 ] [ -4.8354089 -3.4516626 1.4612542 ] [ 2.4493341 -1.9447773 0.0528886 ] [ 3.5286847 2.9059164 -2.9058413 ] [ -1.2794046 -0.7055032 3.4430589 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.370900182540251e-09 -1.61042783039712e-10 -8.465008851929414e-10 ] [ 2.668825866315262e-09 3.377717884377299e-09 -1.580828418416151e-09 ] [ -1.078756413585662e-09 1.903924156854989e-09 -8.593122098881824e-10 ] [ -7.747179091588246e-09 -5.530173120609742e-09 2.341187316285808e-09 ] [ 3.92426583154821e-09 -3.115876722722548e-09 8.473687842684288e-11 ] [ 5.653576128514661e-09 4.655791318079302e-09 -4.65567099461508e-09 ] [ -2.049832138663976e-09 -1.130340732939586e-09 5.516388473617366e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.528197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.12876206797767e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.935516 1.214307 3.7917092 ] [ 2.1617853 5.2890723 2.1653486 ] [ 2.7486712 3.1254353 1.2152179 ] [ 0.9782839 3.3309984 3.0283183 ] [ 4.0583576 1.8559239 2.8550146 ] [ 4.2444475 4.335932 2.9066705 ] [ 2.9192655 3.2615681 4.6689159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.935516e-10 1.214307e-10 3.7917092e-10 ] [ 2.1617853e-10 5.289072300000001e-10 2.1653486e-10 ] [ 2.7486712e-10 3.1254353e-10 1.2152179e-10 ] [ 9.782839e-11 3.3309984e-10 3.0283183e-10 ] [ 4.0583576e-10 1.8559239e-10 2.8550146e-10 ] [ 4.2444475e-10 4.335932e-10 2.9066705e-10 ] [ 2.9192655e-10 3.2615681e-10 4.6689159e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-05 -1.29e-05 1.61e-05 ] [ 3.1e-06 7.3e-06 1.58e-05 ] [ -1.08e-05 2.56e-05 1.24e-05 ] [ 3.76e-05 -3.2e-06 -3.86e-05 ] [ -3.03e-05 -3.81e-05 1.49e-05 ] [ -1.11e-05 2.13e-05 -2.99e-05 ] [ -1.14e-05 1e-07 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-14 -2.066807840832e-14 2.579504359488e-14 ] [ 4.96674752448e-15 1.169588933184e-14 2.531439060864e-14 ] [ -1.730350750464e-14 4.101572149248001e-14 1.986699009792e-14 ] [ 6.024184094208e-14 -5.126965186560001e-15 -6.184401756288e-14 ] [ -4.854595161024e-14 -6.104292925248e-14 2.387243164992e-14 ] [ -1.778416049088e-14 3.412636202304e-14 -4.790508096192e-14 ] [ -1.826481347712e-14 1.6021766208e-16 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.361976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.42256585212907e-18 } }