Rutile (TiO2)
- Formula: O2Ti
- Molecular weight: 79.866
- CAS Registry Number: 1317-80-2
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Condensed phase thermochemistry data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°solid | -225.6 ± 0.2 | kcal/mol | Review | Cox, Wagman, et al., 1984 | rutile phase; CODATA Review value |
| ΔfH°solid | -224.36 | kcal/mol | Review | Chase, 1998 | rutile phase; Data last reviewed in December, 1973 |
| Quantity | Value | Units | Method | Reference | Comment |
| S°solid,1 bar | 12.10 ± 0.072 | cal/mol*K | Review | Cox, Wagman, et al., 1984 | rutile phase; CODATA Review value |
Solid Phase Heat Capacity (Shomate Equation)
Cp° = A + B*t + C*t2 + D*t3 +
E/t2
H° − H°298.15= A*t + B*t2/2 +
C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 −
E/(2*t2) + G
Cp = heat capacity (cal/mol*K)
H° = standard enthalpy (kcal/mol)
S° = standard entropy (cal/mol*K)
t = temperature (K) / 1000.
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| Temperature (K) | 298. to 2000. |
|---|---|
| A | 16.08468 |
| B | 4.471654 |
| C | -2.767448 |
| D | 0.585459 |
| E | -0.355036 |
| F | -230.5244 |
| G | 28.16993 |
| H | -224.3599 |
| Reference | Chase, 1998 |
| Comment | rutile phase; Data last reviewed in December, 1973 |
References
Go To: Top, Condensed phase thermochemistry data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Cox, Wagman, et al., 1984
Cox, J.D.; Wagman, D.D.; Medvedev, V.A.,
CODATA Key Values for Thermodynamics, Hemisphere Publishing Corp., New York, 1984, 1. [all data]
Chase, 1998
Chase, M.W., Jr.,
NIST-JANAF Themochemical Tables, Fourth Edition,
J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, References
- Symbols used in this document:
S°solid,1 bar Entropy of solid at standard conditions (1 bar) ΔfH°solid Enthalpy of formation of solid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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