JAVIER
SEGARRA MARTI
INVEST CONT RAMON Y CAJAL
Hebrew University of Jerusalem
Jerusalén, IsraelPublicaciones en colaboración con investigadores/as de Hebrew University of Jerusalem (3)
2023
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The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
Journal of Chemical Theory and Computation, Vol. 19, Núm. 20, pp. 6933-6991
2020
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Modern quantum chemistry with [open]molcas
Journal of Chemical Physics, Vol. 152, Núm. 21
2016
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Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table
Journal of Computational Chemistry, Vol. 37, Núm. 5, pp. 506-541