{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "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" [ [ 3.422431269292923e-09 5.559077348154947e-09 6.301033805575757e-09 ] [ -2.73064040382832e-09 -1.499843997852883e-09 1.273688116073211e-09 ] [ 1.723887730193355e-09 -3.541171943231315e-09 8.053055597012698e-10 ] [ 1.059494886032742e-09 -2.504868083131666e-09 -1.571233142851841e-09 ] [ -2.761508899910625e-09 1.664244142001481e-09 7.072911231825331e-10 ] [ -1.452732635188907e-09 2.786241700405914e-09 -2.45481800810982e-09 ] [ 2.574020269132664e-09 8.43279709096823e-10 -2.007596039239433e-09 ] [ -1.83495205550617e-09 -3.306958875443301e-09 -3.053671414331677e-09 ] ] "source-value" [ [ 2.1361136000000003 3.469703200000001 3.932796000000001 ] [ -1.7043317000000004 -0.9361290000000002 0.7949736000000002 ] [ 1.0759661000000003 -2.2102257000000005 0.5026322000000001 ] [ 0.6612847000000001 -1.5634157000000004 -0.9806866000000002 ] [ -1.7235983000000004 1.0387395000000001 0.44145640000000014 ] [ -0.9067244000000002 1.7390353000000005 -1.5321769000000005 ] [ 1.6065771000000004 0.5263338000000001 -1.2530429000000003 ] [ -1.1452870000000002 -2.0640414000000002 -1.9059518000000004 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.680779645576887e-18 "source-value" -35.456638 } }