{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6441978 -1.9459924 -2.0804052 ] [ 0.3263777 0.4581736 3.9203182 ] [ -2.5655815 -5.1540162 -4.6792052 ] [ -0.6960448 0.835216 7.9218687 ] [ 2.5480075 1.4246899 -5.1631137 ] [ 1.382163 1.3438153 2.713153 ] [ 1.2426616 1.2065054 -2.5365548 ] [ -0.5933857 1.8316084 -0.096061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.634295275130794e-09 -3.117823527534482e-09 -3.333176573230748e-09 ] [ 5.229147204904762e-10 7.340750301877709e-10 6.281042166136739e-09 ] [ -4.110514698056995e-09 -8.257644258864458e-09 -7.496913175365788e-09 ] [ -1.115186705589412e-09 1.338163548518093e-09 1.269223282418729e-08 ] [ 4.082358046123056e-09 2.28260484966989e-09 -8.272220060672184e-09 ] [ 2.214469244734791e-09 2.153029456333338e-09 4.346950305253383e-09 ] [ 1.990963363085921e-09 1.933034744748952e-09 -4.06400879793802e-09 ] [ -9.507086956570426e-10 2.934560156940894e-09 -1.539066883706688e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -29.815999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.777049652359618e-18 } }