{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.76845 -2.6076398 -14.5433712 ] [ -8.1783831 -4.278345 -0.315258 ] [ 5.6504302 -0.1348344 9.4630439 ] [ -7.5384222 7.3095452 2.3499487 ] [ 8.2315103 -1.88778 -3.0868798 ] [ 2.8306767 -11.3478477 8.6845687 ] [ 4.7726382 12.9469017 -2.5520523 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.24207572825376e-09 -4.177899523027588e-09 -2.330104932425604e-08 ] [ -1.310321419876583e-08 -6.854664334716576e-09 -5.050989971201664e-10 ] [ 9.052987163902269e-09 -2.160285233595955e-10 1.516146769818406e-08 ] [ -1.20778838065597e-08 1.171118242812086e-08 3.765032867219353e-09 ] [ 1.318833335653439e-08 -3.024556981213824e-09 -4.94572664677978e-09 ] [ 4.535244029783296e-09 -1.818125628133905e-08 1.391421293287145e-08 ] [ 7.646609343576995e-09 2.074322321553578e-08 -4.088838530118868e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1937078 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.47299436956266e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4501103 2.7991359 0.9384198 ] [ 1.2999612 2.0004127 2.8831736 ] [ 3.6024838 3.5511416 4.9203267 ] [ 1.4214912 4.1969107 3.8336989 ] [ 4.6311067 2.1533972 2.0250543 ] [ 3.3982241 1.3791412 3.9285772 ] [ 3.6704357 4.5880497 2.4761096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4501103e-10 2.7991359e-10 9.384198e-11 ] [ 1.2999612e-10 2.0004127e-10 2.8831736e-10 ] [ 3.6024838e-10 3.5511416e-10 4.9203267e-10 ] [ 1.4214912e-10 4.1969107e-10 3.8336989e-10 ] [ 4.631106700000001e-10 2.1533972e-10 2.0250543e-10 ] [ 3.398224100000001e-10 1.3791412e-10 3.9285772e-10 ] [ 3.6704357e-10 4.5880497e-10 2.4761096e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 3e-06 -1.25e-05 ] [ -2.8e-06 -5.2e-06 1.12e-05 ] [ -8.6e-06 -2.1e-06 -4.2e-06 ] [ -2.4e-06 6e-06 -1.7e-06 ] [ 1.95e-05 -1.54e-05 -4.3e-06 ] [ 3e-06 -6e-07 2.1e-06 ] [ 2.8e-06 1.43e-05 9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.858524880128e-14 4.8065298624e-15 -2.002720776e-14 ] [ -4.48609453824e-15 -8.33131842816e-15 1.794437815296e-14 ] [ -1.377871893888e-14 -3.36457090368e-15 -6.72914180736e-15 ] [ -3.84522388992e-15 9.6130597248e-15 -2.72370025536e-15 ] [ 3.12424441056e-14 -2.467351996032e-14 -6.889359469440001e-15 ] [ 4.8065298624e-15 -9.6130597248e-16 3.36457090368e-15 ] [ 4.48609453824e-15 2.291112567744e-14 1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.968507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.039089844688114e-18 } }