{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1318576 0.9447937 0.002862 ] [ -48.1832625 24.7512984 6.8838224 ] [ 7.9957879 -33.1157111 9.8902715 ] [ 11.9687761 12.8594229 -48.5358636 ] [ 27.0868409 -5.4398039 31.7589076 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.813435784794798e-09 1.513726377619129e-09 4.5854294887296e-12 ] [ -7.719809669136937e-08 3.965595163092444e-08 1.102909931101935e-08 ] [ 1.281066443825553e-08 -5.305721810558705e-08 1.584596177066455e-08 ] [ 1.91760932470098e-08 2.060306672736014e-08 -7.776302593025772e-08 ] [ 4.339790322130923e-08 -8.715526630316662e-09 5.088337925886744e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.075155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.017482710393623e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2082237 1.8493665 0.2189429 ] [ 0.0639719 2.0150671 2.646921 ] [ 3.0892778 -0.1970532 3.7635838 ] [ 2.6365788 1.6994456 0.373733 ] [ 2.492294 1.8642535 2.8017919 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.082237e-11 1.8493665e-10 2.189429e-11 ] [ 6.39719e-12 2.0150671e-10 2.646921e-10 ] [ 3.0892778e-10 -1.970532e-11 3.763583800000001e-10 ] [ 2.6365788e-10 1.6994456e-10 3.73733e-11 ] [ 2.492294e-10 1.8642535e-10 2.8017919e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 8.7e-06 -1.5e-06 ] [ 1.87e-05 2.6e-06 -1.12e-05 ] [ 1.18e-05 8.1e-06 3.58e-05 ] [ -2.12e-05 2.3e-05 -2.74e-05 ] [ -1.39e-05 -4.24e-05 4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 1.393893660096e-14 -2.4032649312e-15 ] [ 2.996070280896e-14 4.16565921408e-15 -1.794437815296e-14 ] [ 1.890568412544e-14 1.297763062848e-14 5.735792302464001e-14 ] [ -3.396614436096001e-14 3.68500622784e-14 -4.389963940992e-14 ] [ -2.227025502912e-14 -6.793228872192001e-14 6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }