{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3068994 1.7867444 -1.0827201 ] [ 0.772738 -1.3876666 -0.2222899 ] [ 0.026598 1.942667 1.415589 ] [ -0.3973435 -2.3441731 -1.1422999 ] [ 1.758188 -0.141959 -0.2362481 ] [ -0.2872941 0.202521 0.5105147 ] [ -0.5659871 -0.0581337 0.7574542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.093883664417548e-09 2.862680105025324e-09 -1.734708831090238e-09 ] [ 1.23806275760375e-09 -2.223286983985026e-09 -3.561476808199699e-10 ] [ 4.26146937600384e-11 3.112495649399674e-09 2.268023600461651e-09 ] [ -6.366144661268449e-10 -3.75577933592826e-09 -1.830166193722178e-09 ] [ 2.81692770857111e-09 -2.274433909121472e-10 -3.785111825284204e-10 ] [ -4.602958903137773e-10 3.244744114210369e-10 8.179347169147257e-10 ] [ -9.068112992943916e-10 -9.314045502060097e-11 1.213575410566767e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.569408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.135364798049649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4986701 3.895681 2.9028468 ] [ 5.8402091 2.1847906 1.3073861 ] [ 3.6750346 1.3908998 1.067651 ] [ 3.2787876 1.7646768 3.3782074 ] [ 5.4429141 2.5596362 3.6238729 ] [ 4.7877422 4.3459495 1.9999684 ] [ 2.8960473 3.5209865 0.5863544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4986701e-10 3.895681e-10 2.9028468e-10 ] [ 5.8402091e-10 2.1847906e-10 1.3073861e-10 ] [ 3.6750346e-10 1.3908998e-10 1.067651e-10 ] [ 3.2787876e-10 1.7646768e-10 3.3782074e-10 ] [ 5.442914100000001e-10 2.5596362e-10 3.6238729e-10 ] [ 4.787742200000001e-10 4.3459495e-10 1.9999684e-10 ] [ 2.8960473e-10 3.5209865e-10 5.863544000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.64e-05 9e-07 3.75e-05 ] [ -3.14e-05 5.87e-05 2.33e-05 ] [ 1.52e-05 5e-07 -6.11e-05 ] [ -3.7e-06 7.1e-06 6.8e-05 ] [ -1.58e-05 -9.6e-06 1.01e-05 ] [ 1.68e-05 -5.09e-05 -2.47e-05 ] [ -7.4e-06 -6.8e-06 -5.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.229746278912e-14 1.44195895872e-15 6.008162327999999e-14 ] [ -5.030834589312e-14 9.404776764096e-14 3.733071526464e-14 ] [ 2.435308463616e-14 8.010883104e-16 -9.789299153088e-14 ] [ -5.928053496960001e-15 1.137545400768e-14 1.089480102144e-13 ] [ -2.531439060864e-14 -1.538089555968e-14 1.618198387008e-14 ] [ 2.691656722944e-14 -8.155078999872e-14 -3.957376253376001e-14 ] [ -1.185610699392e-14 -1.089480102144e-14 -8.49153609024e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.303661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573440421244875e-18 } }