{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3240174 -0.3328552 -1.6850593 ] [ -0.161557 -0.1381168 0.3319401 ] [ -0.1143379 -0.4603956 -0.8042007 ] [ -1.1752556 -1.1389114 4.3896496 ] [ 1.517238 0.8601675 -2.2044165 ] [ -0.7250649 0.3520998 2.2767666 ] [ 0.2864579 0.0077064 -2.6880212 ] [ 0.0485021 0.8503053 0.3833415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.19133103012402e-10 -5.332928195517082e-10 -2.699762615121613e-09 ] [ -2.588428483265856e-10 -2.212875078997095e-10 5.318266677260141e-10 ] [ -1.831895102513683e-10 -7.376350666391885e-10 -1.288471559970994e-09 ] [ -1.882967045784277e-09 -1.824737218242597e-09 7.032993962624072e-09 ] [ 2.430883251789351e-09 1.378140258471984e-09 -3.531864578805763e-09 ] [ -1.16168203134269e-09 5.641260677483559e-10 3.647782217538305e-09 ] [ 4.589561502234643e-10 1.234701391053312e-11 -4.306684722854761e-09 ] [ 7.770893067970368e-11 1.36233927220233e-09 6.141807890824032e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.759876 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729363728990702e-18 } }