{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" [ 6.09182 5.683645 5.430674 5.246878 5.102436 4.983432 4.882234 4.7942 4.716297 4.646431 4.583098 4.52518 4.471824 4.422363 4.376267 4.333107 4.292532 4.254249 4.218013 4.183616 4.150881 4.119654 4.089802 4.06121 4.041745 4.021259 3.999639 3.976752 3.95244 3.926514 3.898743 3.868846 3.83647 3.801166 3.76235 3.719248 3.670792 3.615463 3.550982 3.47371 3.377285 3.24897 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.091820000000001e-10 5.683645000000001e-10 5.430674e-10 5.246878e-10 5.102436e-10 4.983431999999999e-10 4.882234e-10 4.7942e-10 4.716297000000001e-10 4.646431e-10 4.583098e-10 4.52518e-10 4.471824e-10 4.4223629999999997e-10 4.3762670000000005e-10 4.3331070000000004e-10 4.292532e-10 4.254249e-10 4.2180130000000003e-10 4.183616e-10 4.150881e-10 4.119654e-10 4.089802e-10 4.06121e-10 4.041745e-10 4.0212589999999997e-10 3.9996390000000004e-10 3.976752e-10 3.9524400000000006e-10 3.926514e-10 3.8987430000000005e-10 3.8688460000000003e-10 3.83647e-10 3.801166e-10 3.7623500000000005e-10 3.719248e-10 3.6707920000000004e-10 3.615463e-10 3.550982e-10 3.47371e-10 3.377285e-10 3.24897e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.860467 1.17882 1.41579 1.60809 1.76707 1.90112 2.01863 2.12301 2.21391 2.2932 2.36234 2.42245 2.47519 2.5211 2.56036 2.59349 2.62098 2.6432 2.66053 2.67326 2.68433 2.69339 2.69869 2.70042 2.69958 2.69683 2.69174 2.68374 2.67215 2.65602 2.63419 2.60555 2.56741 2.51667 2.44888 2.3574 2.23275 2.06396 1.81827 1.44425 0.837195 -0.280047 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.3786201103699137e-19 1.888677844131456e-19 2.2683456379624325e-19 2.576444202142272e-19 2.831158241317056e-19 3.045930017335296e-19 3.234201792045504e-19 3.401436987724608e-19 3.547074842555328e-19 3.6741114268185605e-19 3.7848859183806726e-19 3.8811927550569603e-19 3.965691550037952e-19 4.0392474786988804e-19 4.1021489328314883e-19 4.1552290442785925e-19 4.199272879584384e-19 4.2348732440985605e-19 4.262638964937024e-19 4.2830346733198083e-19 4.300770768512064e-19 4.3152864886965122e-19 4.323778024786752e-19 4.326549790340736e-19 4.3252039619792645e-19 4.320797976272064e-19 4.312642897272192e-19 4.299825484305792e-19 4.28125625727072e-19 4.255413148377216e-19 4.220437632745152e-19 4.1745512943254403e-19 4.1134442780081285e-19 4.032149836268736e-19 3.923538283144704e-19 3.7769711658739204e-19 3.5772598500912e-19 3.306828458266368e-19 2.913189684302016e-19 2.3139435845904e-19 1.341334256050656e-19 -4.486847561251776e-20 ] } }