{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5011548 -2.2803951 -0.704593 ] [ -2.8165649 0.5208691 -5.2487372 ] [ -2.598173 -1.2214185 3.0769007 ] [ 3.0849536 0.0912899 -0.6750352 ] [ 1.2797515 -0.8227231 0.9239556 ] [ 0.5005774 -0.3777793 -0.0442121 ] [ 4.0506102 4.090157 2.6717213 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.609468366361701e-09 -3.653595715406878e-09 -1.128882431779334e-09 ] [ -4.51263443374589e-09 8.345242945171372e-10 -8.409404030563254e-09 ] [ -4.162732037393798e-09 -1.956928164912605e-09 4.929738366063154e-09 ] [ 4.942640534172794e-09 1.462625434951699e-10 -1.081525615657052e-09 ] [ 2.050387933733731e-09 -1.318147716212101e-09 1.480340060977236e-09 ] [ 8.020134071808499e-10 -6.052691622821894e-10 -7.083559297647168e-11 ] [ 6.489792962414013e-09 6.553153920801464e-09 4.280569404153384e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.346604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.458797013747576e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9804134 1.5132553 2.7344699 ] [ 1.7025204 3.8150462 2.0772529 ] [ 1.6755342 3.2672259 4.5886693 ] [ 4.3036915 1.83159 2.7899485 ] [ 4.0604622 2.4245451 5.0463332 ] [ 4.0306543 4.093216 2.1441282 ] [ 3.782497 4.7263075 4.3890481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9804134e-10 1.5132553e-10 2.7344699e-10 ] [ 1.7025204e-10 3.8150462e-10 2.0772529e-10 ] [ 1.6755342e-10 3.2672259e-10 4.588669300000001e-10 ] [ 4.3036915e-10 1.83159e-10 2.7899485e-10 ] [ 4.0604622e-10 2.4245451e-10 5.0463332e-10 ] [ 4.0306543e-10 4.093216e-10 2.1441282e-10 ] [ 3.782497e-10 4.7263075e-10 4.3890481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 -9.6e-06 8.3e-06 ] [ -1.83e-05 1.2e-05 -1.2e-05 ] [ 2.79e-05 1.13e-05 -6.5e-06 ] [ 1.53e-05 -4.2e-06 -1.98e-05 ] [ -1.94e-05 -7e-06 1.55e-05 ] [ -6.7e-06 -1.19e-05 -6.1e-06 ] [ -4.7e-06 9.4e-06 2.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 -1.538089555968e-14 1.329806595264e-14 ] [ -2.931983216064e-14 1.92261194496e-14 -1.92261194496e-14 ] [ 4.470072772032e-14 1.810459581504e-14 -1.04141480352e-14 ] [ 2.451330229824e-14 -6.72914180736e-15 -3.172309709184e-14 ] [ -3.108222644352e-14 -1.12152363456e-14 2.48337376224e-14 ] [ -1.073458335936e-14 -1.906590178752e-14 -9.77327738688e-15 ] [ -7.53023011776e-15 1.506046023552e-14 3.300483838848e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.320543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93527456749611e-18 } }