{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3287533 -0.4654972 -0.8008545 ] [ -0.188159 0.1516513 -0.0566728 ] [ 1.1995058 1.8694707 -0.6702612 ] [ -1.9948212 1.3051578 -1.6387368 ] [ -0.823774 0.3170887 1.4183349 ] [ -1.0307915 -0.847128 1.4766701 ] [ 0.7131698 -1.9042594 0.1217622 ] [ 1.7961168 -0.4264839 0.1497582 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.267208512708486e-10 -7.458087308878617e-10 -1.283110356562474e-09 ] [ -3.014639507931072e-10 2.42972167373927e-10 -9.079983519527425e-11 ] [ 1.921820149274001e-09 2.99522224881061e-09 -1.073876824469353e-09 ] [ -3.196055889316201e-09 2.091093313614762e-09 -2.625545788604605e-09 ] [ -1.319831443622899e-09 5.080321018598649e-10 2.272423017244706e-09 ] [ -1.651510042219363e-09 -1.357248676425062e-09 2.365886310854398e-09 ] [ 1.142623980220612e-09 -3.050959890618635e-09 1.950845501371738e-10 ] [ 2.87769634518611e-09 -6.833025337276052e-10 2.399390868130906e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.046124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.775225714325778e-18 } }