{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7687773 0.3761885 -0.8838243 ] [ 0.4439375 -0.1856934 3.6184599 ] [ -0.7238583 0.6758297 -0.9160256 ] [ -0.6115633 -1.7628456 -3.0437862 ] [ -2.8168369 0.6320387 0.7453115 ] [ 6.194444 -1.2556168 -0.8006225 ] [ -2.274728 3.3740138 1.4115754 ] [ 2.5573823 -1.8539148 -0.1310881 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.436070258261748e-09 6.027204197138207e-10 -1.416042630354925e-09 ] [ 7.112662835964e-10 -2.975136241168627e-10 5.797411855082306e-09 ] [ -1.159748845032033e-09 1.082798544982278e-09 -1.467634800374292e-09 ] [ -9.798324213992967e-10 -2.824390006400148e-09 -4.876683088353674e-09 ] [ -4.513070225786747e-09 1.012637628580825e-09 1.194120660513379e-09 ] [ 9.924593355654836e-09 -2.01171988164371e-09 -1.282738651586448e-09 ] [ -3.644516020279143e-09 5.405766028616568e-09 2.261593104376409e-09 ] [ 4.097378131507732e-09 -2.970298949515108e-09 -2.100262890850925e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.89126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.590196104225422e-18 } }