{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3390923 -6.2334448 -3.8562766 ] [ -7.9267828 2.9981204 5.5647517 ] [ -0.6263426 2.0078726 -12.6838939 ] [ 10.1292714 -8.9066615 6.109125 ] [ 2.7629464 10.1341133 4.8662938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.9519922385533e-09 -9.987079525607332e-09 -6.178436211858114e-09 ] [ -1.270010608031956e-08 4.803518411223544e-09 8.915715074297055e-09 ] [ -1.003511470331086e-09 3.21696653726491e-09 -2.032183826728773e-08 ] [ 1.622888182281809e-08 -1.427004482467946e-08 9.7878972485448e-09 ] [ 4.426728126603525e-09 1.623663940179834e-08 7.79666215630399e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.328885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.654869806593181e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5682473 0.4649426 0.8424621 ] [ 2.2328339 2.4524441 2.3119008 ] [ 3.5625812 2.6218292 0.080177 ] [ 4.5581254 1.3026508 2.0916855 ] [ 4.3341142 3.7863385 2.1467151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5682473e-10 4.649426e-11 8.424621e-11 ] [ 2.2328339e-10 2.4524441e-10 2.3119008e-10 ] [ 3.5625812e-10 2.6218292e-10 8.0177e-12 ] [ 4.5581254e-10 1.3026508e-10 2.0916855e-10 ] [ 4.3341142e-10 3.7863385e-10 2.1467151e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.15e-05 7.4e-06 -1.24e-05 ] [ 4.23e-05 1.5e-05 -1.96e-05 ] [ -1.32e-05 -2.96e-05 5e-05 ] [ -2.33e-05 9e-07 -1.8e-05 ] [ -1.73e-05 6.4e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.84250311392e-14 1.185610699392e-14 -1.986699009792e-14 ] [ 6.777207105984e-14 2.4032649312e-14 -3.140266176767999e-14 ] [ -2.114873139456e-14 -4.742442797568e-14 8.010883104e-14 ] [ -3.733071526464e-14 1.44195895872e-15 -2.88391791744e-14 ] [ -2.771765553984e-14 1.025393037312e-14 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }