{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3987833 -1.0079749 -1.1368738 ] [ 2.3371405 1.2348654 1.4573047 ] [ -1.3211294 1.9050235 -1.8637237 ] [ -0.6002183 0.199336 0.5728828 ] [ -1.1093204 -0.9214583 -3.1368949 ] [ 2.2049712 -0.4871328 -1.0385318 ] [ -1.0502463 0.4563473 3.6535063 ] [ 0.9375861 -1.3790063 1.4923303 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.241097900825473e-09 -1.614953819133218e-09 -1.821472623160055e-09 ] [ 3.744511868624822e-09 1.97847247371484e-09 2.334859519721958e-09 ] [ -2.116682637731532e-09 3.052184113774589e-09 -2.986014539770873e-09 ] [ -9.616557276363206e-10 3.193714788837888e-10 9.178594286184423e-10 ] [ -1.777327209856505e-09 -1.476338945302112e-09 -5.025859670686755e-09 ] [ 3.532753306177321e-09 -7.804727833848422e-10 -1.663911369917341e-09 ] [ -1.682680067941703e-09 7.31148975025204e-10 5.853562377805512e-09 ] [ 1.502178529407051e-09 -2.209411653795911e-09 2.39097671717145e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.558553 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.697108228607771e-18 } }