{ "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" [ 5.44335 0 0 ] "si-unit" "m" "si-value" [ 5.44335e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0871492 5.32556 0 ] "si-unit" "m" "si-value" [ 8.71492e-12 5.32556e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0678412 -0.0738369 5.55618 ] "si-unit" "m" "si-value" [ 6.784120000000001e-12 -7.38369e-12 5.556180000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0586252 0.00658789 -0.0562217 ] [ 1.37481 1.15024 1.36711 ] [ 0.0858543 2.81471 2.72056 ] [ 1.52563 4.03682 4.13778 ] [ 2.84739 -0.239071 2.58831 ] [ 4.11503 1.39706 3.91123 ] [ 2.74645 2.72703 -0.0478687 ] [ 4.08136 4.16337 1.33715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.86252e-12 6.58789e-13 -5.62217e-12 ] [ 1.37481e-10 1.15024e-10 1.36711e-10 ] [ 8.58543e-12 2.81471e-10 2.72056e-10 ] [ 1.52563e-10 4.03682e-10 4.13778e-10 ] [ 2.84739e-10 -2.39071e-11 2.58831e-10 ] [ 4.11503e-10 1.39706e-10 3.91123e-10 ] [ 2.74645e-10 2.72703e-10 -4.786870000000001e-12 ] [ 4.08136e-10 4.16337e-10 1.33715e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8629240999999999 3.4425244999999998 -1.5466226999999992 ] [ 1.1804935999999997 2.3442738999999997 0.0029091999999999985 ] [ 0.027799899999999995 -0.37160439999999995 -1.9224090999999992 ] [ -0.24405149999999998 -2.5678140999999997 -0.4376315999999998 ] [ -13.359764199999999 16.655044699999998 14.858533999999993 ] [ -0.03603979999999999 -2.3824518999999995 1.6228932999999994 ] [ -0.06683669999999999 -0.6664658999999999 1.1045408999999995 ] [ 13.361322699999999 -16.453506899999997 -13.682213899999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.382556829935479e-09 5.515532315872532e-09 -2.47796275155399e-09 ] [ 1.891359262506542e-09 3.755940866276052e-09 4.661052263632798e-12 ] [ 4.454035020753659e-11 -5.953758867715894e-10 -3.080038941008968e-09 ] [ -3.910136107926509e-10 -4.114091751475739e-09 -7.011631238200339e-10 ] [ -2.14047020369897e-08 2.668432345656553e-08 2.380599599029454e-08 ] [ -5.774212545403318e-11 -3.817108765808903e-09 2.600161724735151e-09 ] [ -1.070841990336678e-10 -1.06779609233778e-09 1.76966962127733e-09 ] [ 2.140719902927379e-08 -2.636142430253777e-08 -2.192132341197e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -32.045696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.134286535146726e-18 } }