1. Institute of Chemical Research of Catalonia

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Showing results 6778 to 6797 of 63063 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Jun-2020c00054Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129137.404009; eV
thumbnail.jpeg26-Jun-2020c00055Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129137.281440; eV
thumbnail.jpeg26-Jun-2020c00056Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.033866; eV
thumbnail.jpeg26-Jun-2020c00057Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.351764; eV
thumbnail.jpeg26-Jun-2020c00058Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129137.043022; eV
thumbnail.jpeg26-Jun-2020c00059Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.325737; eV
thumbnail.jpeg26-Jun-2020c00060Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.512588; eV
thumbnail.jpeg26-Jun-2020c00061Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.241187; eV
thumbnail.jpeg26-Jun-2020c00062Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.309492; eV
thumbnail.jpeg26-Jun-2020c00063Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129137.949017; eV
thumbnail.jpeg26-Jun-2020c00064Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.418771; eV
thumbnail.jpeg26-Jun-2020c00065Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.390614; eV
thumbnail.jpeg26-Jun-2020c00066Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.171431; eV
thumbnail.jpeg26-Jun-2020c00067Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.230197; eV
thumbnail.jpeg26-Jun-2020c00068Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.193942; eV
thumbnail.jpeg26-Jun-2020c00069Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.483564; eV
thumbnail.jpeg26-Jun-2020c00070Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.217300; eV
thumbnail.jpeg26-Jun-2020c00071Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.404650; eV
thumbnail.jpeg26-Jun-2020c00072Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.340948; eV
thumbnail.jpeg26-Jun-2020c00073Chuong Nguyën, HuuQuantumEspresso; 6.1; 13369Geometry optimizationPBEUltrasoft-129138.018373; eV
Showing results 6778 to 6797 of 63063 < previous   next >