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test
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adewyer committed Jan 13, 2022
1 parent 78572e9 commit a7520d7
Showing 1 changed file with 26 additions and 0 deletions.
26 changes: 26 additions & 0 deletions tests/enums.js
Original file line number Diff line number Diff line change
Expand Up @@ -6,31 +6,57 @@ export const TOLERANCE = 1e-3;

export const FIXTURES_DIR = path.resolve(__dirname, "./fixtures");
export const Si = readJSONFile(path.join(FIXTURES_DIR, "Si.json"));
console.log(Si);
export const Na4Cl4 = readJSONFile(path.join(FIXTURES_DIR, "Na4Cl4.json"));
console.log(Na4Cl4);
export const Na4Cl4Cartesian = readJSONFile(path.join(FIXTURES_DIR, "Na4Cl4-cartesian.json"));
console.log(Na4Cl4Cartesian);
export const Na4Cl4Poscar = readFile(path.join(FIXTURES_DIR, "Na4Cl4.poscar"));
console.log(Na4Cl4Poscar);
export const SiSupercell = readJSONFile(path.join(FIXTURES_DIR, "Si-supercell.json"));
console.log(SiSupercell);
export const C2H4 = readJSONFile(path.join(FIXTURES_DIR, "C2H4.json"));
console.log(C2H4);
export const C2H4Translated = readJSONFile(path.join(FIXTURES_DIR, "C2H4-translated.json"));
console.log(C2H4Translated);
export const Na = readJSONFile(path.join(FIXTURES_DIR, "Na.json"));
console.log(Na);

export const OSiBasis = readJSONFile(path.join(FIXTURES_DIR, "OSi-basis.json"));
console.log(OSiBasis);
export const Si2Basis = readJSONFile(path.join(FIXTURES_DIR, "Si2-basis.json"));
console.log(Si2Basis);
export const Ge2Basis = readJSONFile(path.join(FIXTURES_DIR, "Ge2-basis.json"));
console.log(Ge2Basis);
export const AsGeBasis = readJSONFile(path.join(FIXTURES_DIR, "AsGe-basis.json"));
console.log(AsGeBasis);
export const FeLiSiBasis = readJSONFile(path.join(FIXTURES_DIR, "FeLiSi-basis.json"));
console.log(FeLiSiBasis);
export const LiFeSiBasis = readJSONFile(path.join(FIXTURES_DIR, "LiFeSi-basis.json"));
console.log(LiFeSiBasis);
export const atomicConstraints = readJSONFile(path.join(FIXTURES_DIR, "atomic-constraints.json"));
console.log(atomicConstraints);
export const Si2BasisRepeated = readJSONFile(path.join(FIXTURES_DIR, "Si2-basis-repeated.json"));
console.log(Si2BasisRepeated);
export const H2HInitial = readJSONFile(path.join(FIXTURES_DIR, "H2+H-initial.json"));
console.log(H2HInitial);
export const H2HFinal = readJSONFile(path.join(FIXTURES_DIR, "H2+H-final.json"));
console.log(H2HFinal);
export const H2HImage = readJSONFile(path.join(FIXTURES_DIR, "H2+H-image.json"));
console.log(H2HImage);
export const SiSlab = readJSONFile(path.join(FIXTURES_DIR, "Si-slab.json"));
console.log(SiSlab);
export const SiPWSCFInput = readFile(path.join(FIXTURES_DIR, "Si-pwscf.in"));
console.log(SiPWSCFInput);

export const Zr1H23Zr1H1 = readJSONFile(path.join(FIXTURES_DIR, "Zr1H23Zr1H1.json"));
console.log(Zr1H23Zr1H1);
export const Zr1H23Zr1H1Poscar = readFile(path.join(FIXTURES_DIR, "Zr1H23Zr1H1.poscar"));
console.log(Zr1H23Zr1H1Poscar);
export const H2O = readFile(path.join(FIXTURES_DIR, "H2O.poscar"));
console.log(H2O);

export const CH4 = readFile(path.join(FIXTURES_DIR, "CH4.xyz"));
console.log(CH4);
export const CH4POSCAR = readFile(path.join(FIXTURES_DIR, "CH4.poscar"));
console.log(CH4POSCAR);

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