{ "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" [ 5.46879 0 0 ] "si-unit" "m" "si-value" [ 5.468790000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.164352 5.45396 0 ] "si-unit" "m" "si-value" [ -1.64352e-11 5.453960000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.164037 0.0480481 5.25114 ] "si-unit" "m" "si-value" [ -1.64037e-11 4.804810000000001e-12 5.251140000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.110213 -0.12035 -0.0596546 ] [ 1.31419 1.39201 1.41434 ] [ -0.168287 2.6382 2.797 ] [ 1.3034 4.08885 4.02601 ] [ 2.55869 -0.0573607 2.7167 ] [ 3.95328 1.36182 4.12861 ] [ 2.72846 2.73806 0.151815 ] [ 4.07331 4.0714 1.3741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.10213e-11 -1.2035e-11 -5.96546e-12 ] [ 1.31419e-10 1.39201e-10 1.41434e-10 ] [ -1.68287e-11 2.6382e-10 2.797e-10 ] [ 1.3034e-10 4.08885e-10 4.02601e-10 ] [ 2.55869e-10 -5.736070000000001e-12 2.7167e-10 ] [ 3.95328e-10 1.36182e-10 4.12861e-10 ] [ 2.72846e-10 2.73806e-10 1.51815e-11 ] [ 4.07331e-10 4.0714e-10 1.3741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.050372800000002 2.4241192000000003 3.7044192000000007 ] [ -3.337735500000001 -3.125819700000001 -2.7623770000000003 ] [ 1.0414343000000001 0.8986306000000002 -0.7046736000000001 ] [ -3.3445948000000008 -1.1779217000000002 1.1886246000000003 ] [ 4.9006959000000005 0.21077240000000005 -2.7918620000000005 ] [ -2.1012077000000002 0.6526563000000001 -1.7223792000000004 ] [ -0.060885700000000015 -1.1578134000000002 -0.4248859000000001 ] [ -3.1480794000000007 1.2753764000000003 3.513133900000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.693765927149157e-09 3.883867140270773e-09 5.935133884780973e-09 ] [ -5.347641828572307e-09 -5.008115285436891e-09 -4.425815883699018e-09 ] [ 1.668561701306146e-09 1.439764949917401e-09 -1.129011576516662e-09 ] [ -5.358631638757904e-09 -1.887238624421558e-09 1.904386560717597e-09 ] [ 7.851780461319601e-09 3.376946143721017e-10 -4.473056061752509e-09 ] [ -3.366505880120882e-09 1.045670673892894e-09 -2.759555709127613e-09 ] [ -9.754964588473382e-11 -1.855021576012096e-09 -6.807422610960606e-10 ] [ -5.04377925665674e-09 2.043378267635038e-09 5.628661046693294e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.521583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.691185028529162e-18 } }