{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7123945 -4.4762356 0.1007502 ] [ -2.395681 4.5824707 -2.0069581 ] [ -2.8273281 -2.1558346 1.0797017 ] [ 1.3356737 -0.5931726 -2.0863662 ] [ 0.1930216 1.5782598 3.3956068 ] [ -2.2548029 -0.5719362 0.3115796 ] [ 4.2367222 1.6364486 -0.794314 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.743558433486506e-09 -7.171720027512661e-09 1.614196149809241e-10 ] [ -3.838304089094765e-09 7.34192742104101e-09 -3.215501346745189e-09 ] [ -4.529878981150885e-09 -3.45402779443172e-09 1.729872821178015e-09 ] [ 2.139985175157433e-09 -9.503672718191502e-10 -3.342727148067337e-09 ] [ 3.092546948294093e-10 2.528650953108484e-09 5.440361828389501e-09 ] [ -3.61259249089204e-09 -9.163428082291929e-10 4.992055506382157e-10 ] [ 6.787977257664342e-09 2.621879688060891e-09 -1.272631320374131e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.929958 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.795307896912593e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5715502 1.9130214 3.2415074 ] [ 1.7376213 5.3215312 2.2313622 ] [ 0.8664422 3.3544882 2.9131392 ] [ 2.6110704 3.2204784 1.0206882 ] [ 2.8502564 4.2491185 4.2941386 ] [ 4.4965469 2.9891963 2.7626803 ] [ 3.9811501 5.095769 2.1383741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5715502e-10 1.9130214e-10 3.241507400000001e-10 ] [ 1.7376213e-10 5.3215312e-10 2.2313622e-10 ] [ 8.664422e-11 3.3544882e-10 2.9131392e-10 ] [ 2.6110704e-10 3.2204784e-10 1.0206882e-10 ] [ 2.8502564e-10 4.2491185e-10 4.294138600000001e-10 ] [ 4.496546900000001e-10 2.9891963e-10 2.7626803e-10 ] [ 3.9811501e-10 5.095769e-10 2.1383741e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 3.56e-05 -8.3e-06 ] [ 2.64e-05 -2.69e-05 6.7e-06 ] [ 1.9e-06 -2.52e-05 5e-06 ] [ -6.9e-06 1.92e-05 7.4e-06 ] [ -6.3e-06 1.09e-05 -1.56e-05 ] [ -7.3e-06 4.2e-06 -1.5e-06 ] [ -2.7e-06 -1.76e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 5.703748770048e-14 -1.329806595264e-14 ] [ 4.229746278912e-14 -4.309855109952001e-14 1.073458335936e-14 ] [ 3.04413557952e-15 -4.037485084416e-14 8.010883104e-15 ] [ -1.105501868352e-14 3.076179111936e-14 1.185610699392e-14 ] [ -1.009371271104e-14 1.746372516672e-14 -2.499395528448e-14 ] [ -1.169588933184e-14 6.72914180736e-15 -2.4032649312e-15 ] [ -4.32587687616e-15 -2.819830852608e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }