{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "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" [ [ -2.317950628319021e-10 -5.247657151404864e-11 3.669628536633562e-10 ] [ -3.056983433842195e-10 -1.93204556090327e-10 9.154821189484992e-10 ] [ 6.886222407616474e-10 2.84542562412528e-10 3.206750097824717e-10 ] [ -7.778987264258651e-10 -2.180767459516263e-10 -7.253796972313651e-10 ] [ 1.302478268643014e-10 -1.076678710943808e-11 -6.312489368414476e-10 ] [ 3.199258319945855e-11 -2.351211814966829e-10 -1.219964570495194e-10 ] [ 2.492217777186816e-10 -4.234564024010746e-10 -2.592770381908224e-10 ] [ 2.153077040978976e-10 8.485595219330075e-10 1.347821469188275e-10 ] ] "source-value" [ [ -0.1446751 -0.0327533 0.2290402 ] [ -0.1908019 -0.1205888 0.571399 ] [ 0.4298042 0.1775975 0.2001496 ] [ -0.4855262 -0.1361128 -0.4527464 ] [ 0.0812943 -0.0067201 -0.3939946 ] [ 0.0199682 -0.1467511 -0.0761442 ] [ 0.155552 -0.2643007 -0.161828 ] [ 0.1343845 0.5296292 0.0841244 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.343396237192905e-17 "source-value" 146.26329 } }