Items where Division is "Chemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie > Research Group Theoretical Chemistry > PD Dr. Denis Usvyat" and Year is 2014

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Martinez-Casado, Ruth and Usvyat, Denis and Mallia, Giuseppe and Maschio, Lorenzo and Casassa, Silvia and Ellis, John and Schuetz, Martin and Harrison, Nicholas M. (2014) Diffraction of helium on MgO(100) surface calculated from first-principles. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 16 (39). pp. 21106-21113. ISSN 1463-9076, 1463-9084

Y

Yang, Jun and Hu, Weifeng and Usvyat, Denis and Matthews, Devin and Schuetz, Martin and Chan, Garnet Kin-Lic (2014) Ab initio determination of the crystalline benzene lattice energy to sub-kilojoule/mole accuracy. SCIENCE, 345 (6197). pp. 640-643. ISSN 0036-8075, 1095-9203

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