{ "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" [ [ 6.969404999999999 -3.2748014999999997 5.559133399999998 ] [ -0.9866000999999999 -9.303407299999998 -1.6753375999999993 ] [ -5.145216499999999 -1.1427687999999998 9.459188399999997 ] [ 0.12904339999999997 -2.4709540999999997 -0.07121839999999997 ] [ -12.747386099999998 6.193936299999999 7.2577437999999965 ] [ 1.7007405999999998 10.284055199999997 -2.6439161999999987 ] [ 2.4441588999999997 4.9435424999999995 -8.179670699999997 ] [ 7.635854799999999 -5.229602399999999 -9.705922599999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.116621775188662e-08 -5.24681040106077e-09 8.90671356538841e-09 ] [ -1.580707614298942e-09 -1.490570166984005e-08 -2.684186734667181e-09 ] [ -8.243545585254402e-09 -1.830917454339671e-09 1.515529050622255e-08 ] [ 2.067503185485427e-10 -3.958904890089904e-09 -1.141044554507827e-10 ] [ -2.042356398573089e-08 9.923779930584453e-09 1.162818743611615e-08 ] [ 2.724886827365364e-09 1.647687280845666e-08 -4.236020722994375e-09 ] [ 3.915974247100245e-09 7.920428217431184e-09 -1.310527716138276e-08 ] [ 1.223398804038346e-08 -8.37874670135957e-09 -1.555060227301434e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -13.554325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.171642262572496e-18 } }