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Results: 1053

Ramon Carbó-Dorca
Mathematical aspects of the LCAO MO first order density function (5): centroid shifting of MO shape functions basis set, properties and applications
J. Math. Chem., 2013, 51, 289-296
DOI: 10.1007/s10910-012-0083-x

Ramon Carbó-Dorca
Collective Euclidian distances and quantum similarity
J. Math. Chem., 2013, 51, 338-353
DOI: 10.1007/s10910-012-0086-7

Ramon Carbó-Dorca
About the concept of Chemical Space: a concerned reflection on some trends of modern scientific thought within theoretical chemical lore
J. Math. Chem., 2013, 51, 413-419
DOI: 10.1007/s10910-012-0091-x

Ramon Carbó-Dorca
Position-momentum Heisenberg uncertainty in Gaussian enfoldments of Euclidian space
J. Math. Chem., 2013, 51, 420-426
DOI: 10.1007/s10910-012-0094-7

Ramon Carbó-Dorca
Simple comparison of atomic population and shape atomic populations distributions between two molecular structures with a coherent number of atoms
J. Math. Chem., 2013, 51, 774-784
DOI: 10.1007/s10910-012-0116-5

Ramon Carbó-Dorca
A naïve geometrical perspective of Fukui functions: definition of Fukui function skew symmetric matrices described on density function sets
J. Math. Chem., 2013, 51, 843-856
DOI: 10.1007/s10910-012-0120-9

Laura Gómez, Mercè Canta, David Font, Irene Prat, Xavi Ribas, Miquel Costas
Regioselective Oxidation of Nonactivated Alkyl CH Groups Using Highly Structured Non-Heme Iron Catalysts
J. Org. Chem., 2013, 78, 1421-1433
DOI: 10.1021/jo302196q

Erik Díaz-Cervantes, Jordi Poater, Juvencio Robles, Marcel Swart, Miquel Solà
Unraveling the Origin of the Relative Stabilities of Group 14 M
J. Phys. Chem. A, 2013, 117, 10462-10469
DOI: 10.1021/jp406071d

Sudip Pan, Miquel Solà, Pratim K. Chattaraj
On the Validity of the Maximum Hardness Principle and the Minimum Electrophilicity Principle during Chemical Reactions
J. Phys. Chem. A, 2013, 117, 1843-1852
DOI: 10.1021/jp312750n

Robert Ponec, Eloy Ramos-Cordoba, Pedro Salvador
Bonding Quandary in the [Cu
J. Phys. Chem. A, 2013, 117, 1975-1982
DOI: 10.1021/jp309295r

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