{ "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" [ [ 0.18095540000000002 -0.7981917000000002 0.38223030000000013 ] [ -0.6244371000000001 0.30096000000000006 1.0358718000000002 ] [ -0.023316400000000004 0.16819770000000003 -0.5746806000000001 ] [ -0.4067670000000001 1.4250087000000002 -1.3665926000000002 ] [ -0.2757046000000001 -0.15500860000000002 0.11885420000000002 ] [ -1.4203251000000001 0.09888550000000003 -0.3511675000000001 ] [ 0.6206784000000001 -1.7373227000000004 -0.9555898000000003 ] [ 1.9489165000000004 0.6974711000000001 1.7110742000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.899225112875123e-10 -1.278844080656608e-09 6.124004504213705e-10 ] [ -1.000458522780152e-09 4.821910757959681e-10 1.659649580106014e-09 ] [ -3.735699096122113e-11 2.694824226123322e-10 -9.207398217473166e-10 ] [ -6.517125775129538e-10 2.283115623576601e-09 -2.189522713878286e-09 ] [ -4.417274643670158e-10 -2.48351154942939e-10 1.904254205238874e-10 ] [ -2.275611669155422e-09 1.584320362361185e-10 -5.626323584847841e-10 ] [ 9.94436421515551e-10 -2.783497812725133e-09 -1.531023636634948e-09 ] [ 3.122508452191364e-09 1.117471890103659e-09 2.741443079694064e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.253033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.808376190569089e-18 } }