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Lasaga, A.C., Gibbs, G.V. (1991) Quantum mechanical hartree-fock potential surfaces and calculations on minerals. Physics and Chemistry of Minerals, 17 (6) doi:10.1007/bf00202228

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Reference TypeJournal (article/letter/editorial)
TitleQuantum mechanical hartree-fock potential surfaces and calculations on minerals
JournalPhysics and Chemistry of Minerals
AuthorsLasaga, A.C.Author
Gibbs, G.V.Author
Year1991 (February)Volume17
Issue6
PublisherSpringer Science and Business Media LLC
DOIdoi:10.1007/bf00202228Search in ResearchGate
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Mindat Ref. ID151912Long-form Identifiermindat:1:5:151912:3
GUID0
Full ReferenceLasaga, A.C., Gibbs, G.V. (1991) Quantum mechanical hartree-fock potential surfaces and calculations on minerals. Physics and Chemistry of Minerals, 17 (6) doi:10.1007/bf00202228
Plain TextLasaga, A.C., Gibbs, G.V. (1991) Quantum mechanical hartree-fock potential surfaces and calculations on minerals. Physics and Chemistry of Minerals, 17 (6) doi:10.1007/bf00202228
In(1991, February) Physics and Chemistry of Minerals Vol. 17 (6) Springer Science and Business Media LLC

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Lasaga, AntonioC., Gibbs, G.V. (1988) Quantum mechanical potential surfaces and calculations on minerals and molecular clusters. Physics and Chemistry of Minerals, 16 (1) doi:10.1007/bf00201327
Lasaga, Antonio C., Gibbs, G. V. (1987) Applications of quantum mechanical potential surfaces to mineral physics calculations. Physics and Chemistry of Minerals, 14 (2) 107-117 doi:10.1007/bf00308214
Kubicki, J.D., Lasaga, A.C. (1991) Molecular dynamics simulations of pressure and temperature effects on MgSiO3 and Mg2SiO4 melts and glasses. Physics and Chemistry of Minerals, 17 (8) doi:10.1007/bf00202236
Silvi, B., D'Arco, Ph., Saunders, V.R., Dovesi, R. (1991) Periodic Hartree-Fock study of minerals: Tetracoordinated silica polymorphs. Physics and Chemistry of Minerals, 17 (8) doi:10.1007/bf00202237
Catti, M., Pavese, A., Apr�, E., Roetti, C. (1993) Quantum-mechanical Hartree-Fock study of calcite (CaCO3) at variable pressure, and comparison with magnesite (MgCO3) Physics and Chemistry of Minerals, 20 (2) doi:10.1007/bf00207203
Kubicki, J.D., Lasaga, A.C. (1993) Molecular dynamics simulations of interdiffusion in MgSiO3-Mg2SiO4 melts. Physics and Chemistry of Minerals, 20 (4) doi:10.1007/bf00208139
Nada, R., Catlow, C.R.A., Dovesi, R., Pisani, C. (1990) An ab-initio Hartree-Fock study of ?-quartz and stishovite. Physics and Chemistry of Minerals, 17 (4) doi:10.1007/bf00200131
Prencipe, M., Tribaudino, M., Nestola, F. (2003) Charge-density analysis of spodumene (LiAlSi2O6), from ab initio Hartree?Fock calculations. Physics and Chemistry of Minerals, 30 (10) 606-614 doi:10.1007/s00269-003-0343-1
Silvi, B., Bouaziz, A., D'Arco, Ph. (1993) Pseudopotential periodic Hartree-Fock study of Mg2SiO4 polymorphs: Olivine, modified spinel and spinel. Physics and Chemistry of Minerals, 20 (5) doi:10.1007/bf00215104
Maj, S?awomir (1991) On the energy gap for Fe-poor oxide and silicate minerals. Physics and Chemistry of Minerals, 17 (8) doi:10.1007/bf00202241
Lasaga, A. C., Gibbs, G. V. (1990) Ab-initio quantum mechanical calculations of water-rock interactions; adsorption and hydrolysis reactions. American Journal of Science, 290 (3) 263-295 doi:10.2475/ajs.290.3.263
 
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