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1
المصدر: Inorganic Chemistry. 37:4421-4431
مصطلحات موضوعية: Inorganic Chemistry, Bond length, Crystallography, Atomic orbital, Chemistry, Metal ions in aqueous solution, Ab initio, Molecule, Molecular orbital, Physical and Theoretical Chemistry, Elementary charge, Ion
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::60fd60afccd30121c36ec7187cd3e59fTest
https://doi.org/10.1021/ic971613oTest -
2
المؤلفون: Charles W. Bock, Jenny P. Glusker, Philip George
المصدر: Journal of Molecular Structure. 376:425-435
مصطلحات موضوعية: Valence (chemistry), Fission, Organic Chemistry, Ab initio, Enol, Tautomer, Transition state, Analytical Chemistry, Inorganic Chemistry, chemistry.chemical_compound, chemistry, Computational chemistry, Molecular orbital, Conformational isomerism, Spectroscopy
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::e05010815597d21eb84fb9b105926f2fTest
https://doi.org/10.1016/0022-2860Test(95)09068-1 -
3
المصدر: Inorganic chemistry. 40(17)
مصطلحات موضوعية: Molecular Structure, Chemistry, Metal ions in aqueous solution, Ab initio, Ion, Inorganic Chemistry, Metal, Deprotonation, Atomic orbital, Computational chemistry, Non-bonding orbital, Metals, visual_art, visual_art.visual_art_medium, Physical chemistry, Thermodynamics, Molecular orbital, Physical and Theoretical Chemistry
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bfb9016d1d835ced91fae6534899a4e8Test
https://pubmed.ncbi.nlm.nih.gov/11487327Test -
4
المؤلفون: Philip George, Charles W. Bock, Mendel Trachtman
المصدر: Tetrahedron Letters. 26:5667-5670
مصطلحات موضوعية: chemistry.chemical_classification, Organic Chemistry, Inorganic chemistry, Aromaticity, Resonance (chemistry), Biochemistry, chemistry.chemical_compound, Hydrocarbon, chemistry, Drug Discovery, Pyridine, Thermochemistry, Physical chemistry, Benzene, Basis set
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::d8e33cb2e1cd7fdca4e401fd4b4fce16Test
https://doi.org/10.1016/s0040-4039Test(01)80914-x -
5
المصدر: Journal of Molecular Structure. 41:87-98
مصطلحات موضوعية: Chemistry, Organic Chemistry, Spectrum (functional analysis), Ab initio, Structure (category theory), Energy minimization, Molecular physics, Analytical Chemistry, Inorganic Chemistry, Bond length, CNDO/2, Crystallography, Partial geometry, Electron diffraction, Spectroscopy
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::55836909984e6c8c246d6e53f5127648Test
https://doi.org/10.1016/0022-2860Test(77)80043-4 -
6
المؤلفون: Charles W. Bock, Philip George, Mendel Trachtman
المصدر: Journal of Molecular Structure. 71:327-341
مصطلحات موضوعية: Performic acid, Formic acid, Organic Chemistry, Ab initio, Analytical Chemistry, Inorganic Chemistry, chemistry.chemical_compound, Dipole, Crystallography, chemistry, Computational chemistry, Molecule, Hydrogen peroxide, Conformational isomerism, Spectroscopy, Basis set
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::49d0dd8e4c7aef87fee554ef526cf33aTest
https://doi.org/10.1016/0022-2860Test(81)85129-0 -
7
المصدر: Journal of Molecular Structure. 36:317-327
مصطلحات موضوعية: chemistry.chemical_classification, Double bond, Organic Chemistry, Spectrum (functional analysis), Structure (category theory), Ab initio, Molecular physics, Analytical Chemistry, Inorganic Chemistry, CNDO/2, Crystallography, chemistry, Electron diffraction, Partial geometry, Spectral analysis, Spectroscopy
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::cb8b56c0616be37ee414d4a2ad2dd648Test
https://doi.org/10.1016/0022-2860Test(77)85065-5 -
8
المؤلفون: Gilbert J. Mains, Mendel Trachtman, Philip George, Charles W. Bock
المصدر: Journal of Molecular Structure. 49:215-219
مصطلحات موضوعية: Inorganic Chemistry, chemistry.chemical_compound, Molecular geometry, Acetylene, Computational chemistry, Chemistry, Organic Chemistry, Ab initio, Molecular physics, Spectroscopy, Basis set, Analytical Chemistry
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::267f8c58eba0a885481fa16ff0a55e1fTest
https://doi.org/10.1016/0022-2860Test(78)87020-3 -
9
المؤلفون: Philip George, Charles W. Bock, Mendel Trachtman, Gilbert J. Mains, Allan Banks
المصدر: Journal of Molecular Structure. 56:267-275
مصطلحات موضوعية: Ethylene, Chemistry, Organic Chemistry, Conjugated system, Ring (chemistry), Analytical Chemistry, Inorganic Chemistry, Crystallography, chemistry.chemical_compound, Ab initio quantum chemistry methods, Computational chemistry, 1,4-Cyclohexadiene, Methylene, Octatetraene, Spectroscopy, Basis set
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::ea54a1856666970b52f9357ba0b11bfdTest
https://doi.org/10.1016/0022-2860Test(79)80163-5 -
10
المؤلفون: Mendel Trachtman, Philip George, Charles W. Bock
المصدر: Journal of Molecular Structure. 92:109-139
مصطلحات موضوعية: Hydrogen bond, Chemistry, Organic Chemistry, Intermolecular force, Condensed Matter Physics, Ring (chemistry), Biochemistry, Analytical Chemistry, Inorganic Chemistry, Bond length, Ring size, Crystallography, Molecular geometry, Computational chemistry, Intramolecular force, Physical and Theoretical Chemistry, Bond energy, Spectroscopy
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8c00c5ee629631fb3f464f430dc001a9Test
https://doi.org/10.1016/0022-2860Test(83)90355-1