一致价力场 (CVFF) 的扩展，旨在模拟钒磷氧化物的结构以及正丁烷和 1-丁烯在其晶面上的吸附

An Extension of the Consistent Valence Force Field (CVFF) with the Aim to Simulate the Structures of Vanadium Phosphorus Oxides and the Adsorption of n-Butane and of 1-Butene on their Crystal Planes An Extension of the Consistent Valence Force Field (CVFF) with the Aim to Simulate the Structures of Vanadium Phosphorus Oxides and the Adsorption of n-Butane and of 1-Butene on their Crystal Planes Friedrich Ritschla, Martin Faitb, Klaus Fiedlera, Jutta E. H. Köhlerc, Bernd Kubiasb and Manfred Me