{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44972e-10 0.0 0.0 ] "source-value" [ 5.44972 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.09808e-12 5.45304e-10 0.0 ] "source-value" [ -0.0609808 5.45304 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.742489999999999e-12 -1.45247e-11 5.63878e-10 ] "source-value" [ -0.0674249 -0.145247 5.63878 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.76391635066976e-10 5.975059756837651e-10 3.203644759098283e-09 ] [ 4.489878558983005e-09 -2.99959891468565e-09 -4.994994378957691e-09 ] [ -4.616879735142918e-09 2.061626081205009e-09 6.143550578334476e-09 ] [ -8.529021575766209e-09 -1.120677044433569e-08 9.164093145807224e-09 ] [ 8.615335957293892e-09 6.348677251095501e-09 -1.201332041461834e-08 ] [ 1.956595713263789e-09 3.623236070619339e-09 2.175962852265807e-09 ] [ -7.310765566419437e-09 -7.323459932221359e-09 -8.420571522045555e-09 ] [ 5.218465012720902e-09 8.898783912639088e-09 4.741634980115792e-09 ] ] "source-value" [ [ 0.11009500000000003 0.37293390000000004 1.9995578000000005 ] [ 2.8023618000000003 -1.8722024000000004 -3.117630300000001 ] [ -2.8816297000000004 1.2867658000000002 3.8345027000000007 ] [ -5.323396600000001 -6.994716000000002 5.719777100000001 ] [ 5.3772698000000005 3.962532700000001 -7.498124900000001 ] [ 1.2212110000000003 2.2614461000000006 1.3581292000000003 ] [ -4.563021000000001 -4.5709442000000005 -5.255707400000001 ] [ 3.257109700000001 5.5541841000000005 2.9594958000000005 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -8.971150000000001e-13 -3.89651e-13 -3.78043e-12 ] [ 1.32076e-10 1.2724e-10 1.76049e-10 ] [ 2.46678e-11 2.71711e-10 2.69984e-10 ] [ 1.36622e-10 4.37217e-10 4.08545e-10 ] [ 2.70002e-10 -7.780660000000001e-12 3.30264e-10 ] [ 4.02111e-10 1.29847e-10 4.36135e-10 ] [ 2.82584e-10 3.00896e-10 4.36415e-11 ] [ 4.076120000000001e-10 3.84466e-10 1.60166e-10 ] ] "source-value" [ [ -0.00897115 -0.00389651 -0.0378043 ] [ 1.32076 1.2724 1.76049 ] [ 0.246678 2.71711 2.69984 ] [ 1.36622 4.37217 4.08545 ] [ 2.70002 -0.0778066 3.30264 ] [ 4.02111 1.29847 4.36135 ] [ 2.82584 3.00896 0.436415 ] [ 4.07612 3.84466 1.60166 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.288266921679076e-18 "source-value" -20.523748 } }