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- W2022178548 abstract "Using recently published potential energy surfaces, rovibrational energy levels are computed for the ground electronic states of H2O and NO2, using three-dimensional discrete variable representation (DVR) algorithms. Calculations are presented for H2O to demonstrate the accuracy of these algorithms. In the case of NO2, comparisons with previous calculations are made as a test for the accuracy of the new potential energy surface. © 2000 John Wiley & Sons, Inc. Int J Quant Chem 76: 535–540, 2000" @default.
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- W2022178548 date "2000-01-01" @default.
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- W2022178548 title "Rotation-vibration energy levels from recent potential energy surfaces for the ground electronic states of NO2 and H2O" @default.
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- W2022178548 doi "https://doi.org/10.1002/(sici)1097-461x(2000)76:4<535::aid-qua4>3.0.co;2-m" @default.
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