{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.25093930000000003 0.04402530000000001 -0.5794896000000002 ] [ -1.3131879000000002 -0.5522249000000001 0.7525857000000002 ] [ 0.4768969000000001 -1.2405206000000002 -0.10357620000000002 ] [ -0.9990530000000002 -0.7659228000000002 1.8276647000000004 ] [ 0.5337171000000002 0.9488269000000003 -1.1799943000000002 ] [ 0.050767000000000014 0.9853216000000002 1.5525364000000004 ] [ 1.2783769000000003 0.38826310000000014 -1.1216815000000002 ] [ -0.27845640000000005 0.19223150000000006 -1.1480450000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.020490830123162e-10 7.053630696484021e-11 -9.284446967660066e-10 ] [ -2.103958969431529e-09 -8.847618314929867e-10 1.205775223622534e-09 ] [ 7.640730700070347e-10 -1.987533119315661e-09 -1.659473674785108e-10 ] [ -1.600659372727602e-09 -1.227143613607855e-09 2.92824167712662e-09 ] [ 8.551090667862417e-10 1.520188288890655e-09 -1.890559295713186e-09 ] [ 8.133770117827801e-11 1.578659244495495e-09 2.487437543514478e-09 ] [ 2.048185598625355e-09 6.220660666644056e-10 -1.797131890090071e-09 ] [ -4.461363376677576e-10 3.07988817618771e-10 -1.83937087378053e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.23182407419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.202801559886616e-18 } }