THEOCHEM publishes research related to the broad area of theoretical and computational investigation of molecular systems, including
problems of molecular structure, properties, energetics, reactions, interactions, and dynamics.
High quality, original reports
of significance in theoretical and computational chemistry are invited. Reports on new theoretical methods ... click here for full Aims & Scope
THEOCHEM publishes research related to the broad area of theoretical and computational investigation of molecular systems, including
problems of molecular structure, properties, energetics, reactions, interactions, and dynamics.
High quality, original reports
of significance in theoretical and computational chemistry are invited. Reports on new theoretical methods and/or new types of applications
are welcome as are reports that apply methods to specific problems in chemistry and/or to specific molecular systems.
The molecular
problems within the scope of the journal are any for which non-routine calculational work and/or new theoretical methods can provide
significant new insight or new physical understanding. As well, the scope of the journal includes experimental work of any sort if it
is aimed at, and if it includes, critical tests of theoretical/computational methods and approaches.
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Editors:
C.E. Dykstra
A.J. Thakkar
M. Yáñez
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