DOI: 10.1016/s0009-2614(97)00492-2. A density functional study of iron-porphyrin complexes

A density functional study of iron-porphyrin complexes

10.1016/s0009-2614(97)00492-2

Crossref journal-article

Elsevier BV

Chemical Physics Letters (78)

Bibliography

Rovira, C., Ballone, P., & Parrinello, M. (1997). A density functional study of iron-porphyrin complexes. Chemical Physics Letters, 271(4â6), 247â250.

Authors 3

Carme Rovira (first)
Pietro Ballone (additional)
Michele Parrinello (additional)

References 24 Referenced 67

{'key': '10.1016/S0009-2614(97)00492-2_BIB1', 'series-title': 'Biochemistry', 'author': 'Stryer', 'year': '1995'} / Biochemistry by Stryer (1995)
10.1021/cr00027a006 / Chem. Rev. by Momenteau (1994)
10.1103/PhysRevLett.55.2471 / Phys. Rev. Lett. by Car (1985)
{'key': '10.1016/S0009-2614(97)00492-2_BIB3_2', 'series-title': 'Computer simulation in materials science', 'author': 'Galli', 'year': '1991'} / Computer simulation in materials science by Galli (1991)
10.1016/S0009-2614(89)87036-8 / Chem. Phys. Lett. by Yamamoto (1989)
10.1021/ja00104a056 / J. Am. Chem. Soc. by Jewsbury (1994)
10.1016/0009-2614(96)00033-4 / Chem. Phys. Lett. by Nakatsuji (1996)
10.1021/jp953543h / J. Phys. Chem. by Ghosh (1996)
{'key': '10.1016/S0009-2614(97)00492-2_BIB6', 'series-title': 'Density functional theory of atoms and molecules', 'author': 'Parr', 'year': '1989'} / Density functional theory of atoms and molecules by Parr (1989)
10.1063/1.450025 / J. Chem. Phys. by Becke (1986)
10.1103/PhysRevB.33.8822 / Phys. Rev. B by Perdew (1986)
10.1103/PhysRevB.43.1993 / Phys. Rev. B by Trouiller (1991)
Computations have been performed by the CPMD code (version 3.0) written by J. Hutter.
10.1021/j100019a058 / J. Phys. Chem. by Matsuzawa (1995)
10.1016/0921-4526(91)90430-M / Physica B by Delley (1991)
10.1021/ja00843a015 / J. Am. Chem. Soc. by Collman (1975)
10.1126/science.7638612 / Science by Service (1995)
10.1021/cr00027a007 / Chem. Rev. by Springer (1994)
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10.1021/ja00441a025 / J. Am. Chem. Soc. by Peng (1976)
10.1126/science.7638619 / Science by Lim (1995)
10.1021/ja00088a084 / J. Am. Chem. Soc. by Ivanov (1994)
10.1021/ja00103a056 / J. Am. Chem. Soc. by Hu (1994)
10.1006/jmbi.1996.0123 / J. Mol. Biol. by Yang (1996)

Dates

Type	When
Created	22 years, 4 months ago (April 4, 2003, 6:06 p.m.)
Deposited	6 years, 4 months ago (April 30, 2019, 11:28 p.m.)
Indexed	1 month ago (Aug. 2, 2025, 12:24 a.m.)
Issued	28 years, 3 months ago (June 1, 1997)
Published	28 years, 3 months ago (June 1, 1997)
Published Print	28 years, 3 months ago (June 1, 1997)

Funders 0

None

BibTeX

@article{Rovira_1997, title={A density functional study of iron-porphyrin complexes}, volume={271}, ISSN={0009-2614}, url={http://dx.doi.org/10.1016/s0009-2614(97)00492-2}, DOI={10.1016/s0009-2614(97)00492-2}, number={4–6}, journal={Chemical Physics Letters}, publisher={Elsevier BV}, author={Rovira, Carme and Ballone, Pietro and Parrinello, Michele}, year={1997}, month=jun, pages={247–250} }

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