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mtrl-th1995
First-Principles Calculation of the Structure of Mercury
Michael J. Mehl
Mercury has perhaps the strangest behavior of any of the metals. Although the other metals in column IIB have an ground state, mercury's ground state is the body centered tet…
mtrl-th1995★ 25 cited
Application of a new Tight-Binding method for transition metals: Manganese
Michael J. Mehl, Dimitrios A. Papaconstantopoulos
A new tight-binding total energy method, which has been shown to accurately predict ground state properties of transition and noble metals, is applied to Manganese, the element wit…