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Anne B. McCoy Potential energy surfaces and properties of ICN− and ICN International Journal of Quantum Chemistry 113

Version of Record online: 19 MAR 2012 | DOI: 10.1002/qua.24011

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Potential energy surfaces for the ground and excited states of ICN and ICN- were evaluated at the SO-MRCI-SD level of theory with triple zeta basis sets, and the vibrational structure of the ground potential surfaces was characterized.

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