{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4831135000000002 1.5503593000000004 -0.19808810000000004 ] [ -0.6458798000000001 -0.4369338000000001 0.27902920000000003 ] [ -0.024625800000000007 0.34695940000000003 -0.7928479000000003 ] [ 0.37755850000000013 -0.39386310000000013 -0.4454961000000001 ] [ 0.10782960000000003 0.27753590000000006 -0.26526210000000006 ] [ 0.18375760000000002 0.009263700000000001 -0.7071472000000001 ] [ -0.2614176000000001 0.5846539000000001 0.31034100000000003 ] [ -1.2203360000000003 -1.9379754000000005 1.8194714000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.376209775692861e-09 2.483949424299854e-09 -3.173721226786925e-10 ] [ -1.03481351540698e-09 -7.000451191973032e-10 4.470540607605274e-10 ] [ -3.945488102849665e-11 5.558902390467956e-10 -1.270282369230377e-09 ] [ 6.049154016843169e-10 -6.310382506158127e-10 -7.137634360775791e-10 ] [ 1.727620641502157e-10 4.446615304126868e-10 -4.249967350043118e-10 ] [ 2.944121306143181e-10 1.484208356210496e-11 -1.132974711304182e-09 ] [ -4.188371669856462e-10 9.367188098395411e-10 4.972210946756929e-10 ] [ -1.955193808720589e-09 -3.104978877565529e-09 2.915114539294246e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.523684240654234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.807603720065762e-18 } }