{ "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" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.014099300000000004 -1.4159927000000003 0.6441598000000001 ] [ -1.1632799000000003 0.8826039000000002 1.4379745000000002 ] [ -0.34688540000000007 0.6819205000000002 -2.2752126000000006 ] [ 0.2605121000000001 2.3520068000000003 -1.8541088000000003 ] [ -0.8131346000000003 -0.6822421000000001 1.4027677000000003 ] [ -2.9571008000000005 0.8818138000000002 0.5701486000000001 ] [ 1.7010155000000005 -2.6541380000000006 -1.9879397000000005 ] [ 3.332972400000001 -0.045972200000000005 2.0622104000000006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.258956882964545e-11 -2.268670399163469e-09 1.032057771619204e-09 ] [ -1.863779859226562e-09 1.414087334006902e-09 2.30388912520657e-09 ] [ -5.557716779768565e-10 1.092557082344247e-09 -3.645292435069583e-09 ] [ 4.173863960555118e-10 3.768330306922622e-09 -2.970609771779543e-09 ] [ -1.30278524568356e-09 -1.093072342345496e-09 2.247481613353389e-09 ] [ -4.737797767108977e-09 1.412821454258807e-09 9.134787573018511e-10 ] [ 2.725327265718423e-09 -4.252397851976872e-09 -3.185030510900167e-09 ] [ 5.340010457051668e-09 -7.365558404674176e-11 3.304025290050617e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.979028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.764475750070858e-18 } }