{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.009386e-11 2.066549e-11 2.7030565e-10 ] [ 5.990476e-11 2.1508808e-10 1.3009116e-10 ] [ 3.5318156e-10 6.136110000000001e-11 3.975477e-11 ] [ 1.3038152e-10 -4.79447e-12 5.389277e-11 ] [ 2.8625881e-10 2.820822000000001e-10 7.188236000000001e-11 ] [ 2.0443392e-10 3.2294642e-10 2.8927673e-10 ] ] "source-value" [ [ 0.4009386 0.2066549 2.7030565 ] [ 0.5990476 2.1508808 1.3009116 ] [ 3.5318156 0.613611 0.3975477 ] [ 1.3038152 -0.0479447 0.5389277 ] [ 2.8625881 2.820822 0.7188236 ] [ 2.0443392 3.2294642 2.8927673 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.0443773681408e-13 -3.83176560630528e-12 2.46318633681792e-12 ] [ 3.1819227689088e-12 -8.7126364639104e-13 -8.7414756430848e-12 ] [ -1.40318628449664e-12 4.858440384913921e-12 -1.62909318802944e-12 ] [ -3.80388773310336e-12 9.3535071122304e-13 3.43811081057472e-12 ] [ 1.44179874105792e-12 -3.16798383230784e-12 7.336366746643201e-13 ] [ 3.789147708192e-13 2.0772219888672e-12 3.73579522671936e-12 ] ] "source-value" [ [ 0.0001276 -0.0023916 0.0015374 ] [ 0.001986 -0.0005438 -0.005456 ] [ -0.0008758 0.0030324 -0.0010168 ] [ -0.0023742 0.0005838 0.0021459 ] [ 0.0008999 -0.0019773 0.0004579 ] [ 0.0002365 0.0012965 0.0023317 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.734608995318041e-18 "source-value" -17.068087 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.716407980513961e-08 7.263562078599765e-09 3.827293194355382e-08 ] [ -9.619853434325179e-09 -1.171647569924066e-09 4.640047689732672e-10 ] [ 9.962070942450305e-08 3.353998684899392e-08 3.873672137998925e-10 ] [ -6.690912847794675e-08 -6.80524612611044e-08 -4.465338564422263e-08 ] [ 1.565572700915853e-08 1.387823461489243e-08 -6.191035840956447e-08 ] [ -1.158337455603238e-08 1.454232528854236e-08 6.743944012746014e-08 ] ] "source-value" [ [ -16.9544852 4.5335589 23.8880854 ] [ -6.0042403 -0.7312849 0.289609 ] [ 62.1783567 20.9340134 0.2417756 ] [ -41.7613936 -42.4750058 -27.8704514 ] [ 9.7715363 8.6621128 -38.6414067 ] [ -7.2297738 9.0766056 42.0923881 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.828543809507235e-18 "source-value" 17.654382 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.874791e-11 1.657934e-11 2.219954e-10 ] [ 5.100092000000001e-11 2.362694e-10 1.535272e-10 ] [ 2.868635e-10 8.203470000000001e-11 8.272379e-11 ] [ 1.615801e-10 7.153845e-13 7.495484e-11 ] [ 2.741884e-10 2.697599e-10 8.166341000000001e-11 ] [ 2.318736e-10 2.919901e-10 2.403388e-10 ] ] "source-value" [ [ 0.6874791 0.1657934 2.219954 ] [ 0.5100092 2.362694 1.535272 ] [ 2.868635 0.820347 0.8272379 ] [ 1.615801 0.007153845 0.7495484 ] [ 2.741884 2.697599 0.8166341 ] [ 2.318736 2.919901 2.403388 ] ] } "instance-id" 1 }