Unified Approach for Molecular Dynamics and Density-Functional Theory

Physical Review Letters - Tập 55 Số 22 - Trang 2471-2474
Roberto Car1, Michele Parrinello2
1International School for Advanced Studies, Trieste, Italy
2Dipartimento di Fisica Teorica, Università di Trieste, Trieste, Italy, and International School for Advanced Studies, Trieste, Italy

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