Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 0.00 | kJ mol-1 |
| Rotational | 0.00 | kJ mol-1 |
| Vibrational | 0.00 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 0.00 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 0.00 | J mol-1 K-1 |
| Rotational | 0.00 | J mol-1 K-1 |
| Vibrational | 0.00 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 0.00 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 0.00 | J mol-1 K-1 |
| Rotational | 0.00 | J mol-1 K-1 |
| Vibrational | 0.00 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 0.00 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 0.00 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
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| Balls |
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Calculation failed
A.N.NESMEYANOV INSTITUTE OF ORGANOELEMENT COMPOUNDS OF RUSSIAN ACADEMY OF SCIENCES:IGOR S. GERASIMOV
JOHANNES KEPLER UNIVERSITY LINZ:
CHRISTIAN FRIEDL
EXECUTION OF GAMESS BEGUN Wed Dec 11 08:35:26 2024
ECHO OF THE FIRST FEW INPUT CARDS -
1000000 WORDS OF MEMORY AVAILABLE
**** ERROR, NO $DATA GROUP WAS FOUND
EXECUTION OF GAMESS TERMINATED -ABNORMALLY- AT Wed Dec 11 08:35:26 2024