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Results 1 to 25 of 103

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Melting behavior of beryllium clustersROMAN-VELAZQUEZ, C. E; GARZON, I. L.Zeitschrift für Physik. D, atoms, molecules and clusters. 1993, Vol 26, pp S134-S136, issn 0178-7683, SUPConference Paper

The energy optimized configurations of Be18 and Be20 clusters and the effect of He atom in these clustersKATO, H; HIRAO, K; TERAMAE, H et al.Chemical physics. 1984, Vol 86, Num 3, pp 361-366, issn 0301-0104Article

The convergence of coupled-cluster methods for Be2SHIRLEY, W. A; PETERSSON, G. A.Chemical physics letters. 1991, Vol 181, Num 6, pp 588-590, issn 0009-2614, 3 p.Article

The calculation of higher-order energies in the many-body perturbation theory seriesKNOWLES, P. J; SOMASUNDRAM, K; HANDY, N. C et al.Chemical physics letters. 1985, Vol 113, Num 1, pp 8-12, issn 0009-2614Article

Laser vaporization of beryllium: gas phase spectrum and molecular potential of Be2BONDYBEY, V. E; ENGLISH, J. H.The Journal of chemical physics. 1984, Vol 80, Num 1, pp 568-570, issn 0021-9606Article

On the electron affinity of Be2BAUSCHLICHER, C. W. JR; PARTRIDGE, H.The Journal of chemical physics. 1984, Vol 80, Num 1, pp 334-337, issn 0021-9606Article

A multiconfiguration self-consistent-field group function method for problems with repeating potentialsFINK, W. H; BANERJEE, A; SIMONS, J et al.The Journal of chemical physics. 1983, Vol 79, Num 12, pp 6104-6111, issn 0021-9606Article

Diagrammatic perturbation theory. An application to the beryllium dimer using a universal even-tempered basis setWILSON, S.Molecular physics (Print). 1983, Vol 49, Num 6, pp 1489-1493, issn 0026-8976Article

A study of the Be2 potential curve using the full (CCSDT) coupled-cluster method: the importance of T4 clustersSOSA, C; NOGA, J; BARTLETT, R. J et al.The Journal of chemical physics. 1988, Vol 88, Num 9, pp 5974-5976, issn 0021-9606Article

Is fifth-order MBPT enough?LAIDIG, W. D; FITZGERALD, G; BARTLETT, R. J et al.Chemical physics letters. 1985, Vol 113, Num 2, pp 151-158, issn 0009-2614Article

DIRAC-HARTREE-FOCK THEORY AND COMPUTATIONAL PROCEDURE FOR MOLECULESDATTA SN; EWIG CS.1982; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1982; VOL. 85; NO 4; PP. 443-446; BIBL. 18 REF.Article

The many-body expansion of the potential energy function for elemental clustersMURRELL, J. N.International journal of quantum chemistry. 1990, Vol 37, Num 1, pp 95-102, issn 0020-7608, 8 p.Article

FORCE CALCULATIONS IN THE DENSITY FUNCTIONAL FORMALISMHARRIS J; JONES RO; MULLER JE et al.1981; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1981; VOL. 75; NO 8; PP. 3904-3908; BIBL. DISSEM.Article

Electronic structure and bonding of Be2BONDYBEY, V. E.Chemical physics letters. 1984, Vol 109, Num 5, pp 436-441, issn 0009-2614Article

Ground-state properties of Be2: a pseudopotential local-density approachRICHARDSON, S. L; CHOU, M. Y; COHEN, M. L et al.Physical review. A, General physics. 1985, Vol 31, Num 5, pp 3444-3446, issn 0556-2791Article

The ground state potential energy curve of Be2: is the MBPT approach capable of predicting it?DIERCKSEN, G. H. F; KELLO, V; SADLEJ, A. J et al.Chemical physics. 1985, Vol 96, Num 1, pp 59-79, issn 0301-0104Article

The binding energy of the ground state of Be2LENGSFIELD, B. H. III; MCLEAN, A. D; YOSHIMINE, M et al.The Journal of chemical physics. 1983, Vol 79, Num 4, pp 1891-1895, issn 0021-9606Article

Large electron correlation effect leading to Be-Be bondJEUNG, Gwang-Hi.Comptes rendus. Chimie. 2012, Vol 15, Num 2-3, pp 225-228, issn 1631-0748, 4 p.Article

Medium-size polarized basis sets applicability for interaction energy calculations : He2 and Be2 van der Waals systemsNOWEK, A.Collection of Czechoslovak chemical communications. 1993, Vol 58, Num 8, pp 1739-1750, issn 0010-0765Article

Development of a first-principles many-body potential for berylliumBLAISTEN-BAROJAS, E; KHANNA, S. N.Physical review letters. 1988, Vol 61, Num 13, pp 1477-1480, issn 0031-9007Article

On the binding energy of the ground state of Be2RÖEGGEN, I; MOROKUMA, K; YAMASHITA, K et al.Chemical physics letters. 1987, Vol 140, Num 4, pp 349-354, issn 0009-2614Article

Electron difference densities and chemical bondingSCHWARZ, W. H. E; VALTAZANOS, P; RUEDENBERG, K et al.Theoretica chimica acta. 1985, Vol 68, Num 6, pp 471-506, issn 0040-5744Article

FULL CI RESULTS FOR BE2 AND (H2)2 IN LARGE BASIS SETSHARRISON RJ; HANDY NC.1983; CHEMICAL PHYSICS LETTERS; ISSN 0009-2614; NLD; DA. 1983; VOL. 98; NO 2; PP. 97-101; BIBL. 21 REF.Article

Orbital-invariant formulation of the MP2-R12 methodKLOPPER, W.Chemical physics letters. 1991, Vol 186, Num 6, pp 583-585, issn 0009-2614Article

A study of the reliability of different many-body methods: potential energy curve for the ground state of Be2CERNUSAK, I; NOGA, J; DIERCKSEN, G. H. F et al.Chemical physics. 1988, Vol 125, Num 2-3, pp 255-260, issn 0301-0104Article

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