Carlos Eduardo Sabino Bernardes


AuthID: R-000-37E

Confirmed Publications: 101



41
TITLE: AGGREGATES: Finding Structures in Simulation Results of Solutions  Full Text
AUTHORS: Bernardes, CES ;
PUBLISHED: 2017, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 38, ISSUE: 10
INDEXED IN: WOS CrossRef: 43
IN MY: ORCID | CIÊNCIAVITAE
42
TITLE: ForConX: A Forcefield Conversion Tool Based on XML  Full Text
AUTHORS: Lesch, V; Diddens, D; Bernardes, CES ; Golub, B; Dequidt, A; Zeindlhofer, V; Sega, M; Schroder, C;
PUBLISHED: 2017, SOURCE: JOURNAL OF COMPUTATIONAL CHEMISTRY, VOLUME: 38, ISSUE: 9
INDEXED IN: WOS CrossRef: 8
IN MY: ORCID | CIÊNCIAVITAE
43
TITLE: Ionic liquids with anions based on fluorosulfonyl derivatives: from asymmetrical substitutions to a consistent force field model  Full Text
AUTHORS: Gouveia, ASL; Bernardes, CES ; Tome, LC; Lozinskaya, EI; Vygodskii, YS; Shaplov, AS; Lopes, JNC; Marrucho, IM;
PUBLISHED: 2017, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 19, ISSUE: 43
INDEXED IN: Scopus WOS CrossRef: 52
IN MY: ORCID | CIÊNCIAVITAE
44
TITLE: Modeling Halogen Bonds in Ionic Liquids: A Force Field for Imidazolium and Halo-Imidazolium Derivatives
AUTHORS: Bernardes, CES ; Lopes, JNC ;
PUBLISHED: 2017, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 13, ISSUE: 12
INDEXED IN: Scopus WOS CrossRef: 10
IN MY: ORCID | CIÊNCIAVITAE
45
TITLE: Polymorphic Phase Transition in 4 '-Hydroxyacetophenone: Equilibrium Temperature, Kinetic Barrier, and the Relative Stability of Z '=1 and Z '=2 Forms  Full Text
AUTHORS: Joseph, A; Bernardes, CES ; Druzhinina, AI; Varushchenko, RM; Nguyen, TY; Emmerling, F; Yuan, LN; Dupray, V; Coquerel, G; da Piedade, MEM ;
PUBLISHED: 2017, SOURCE: CRYSTAL GROWTH & DESIGN, VOLUME: 17, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef: 39
IN MY: ORCID | CIÊNCIAVITAE
46
TITLE: Structure-property relationships in protic ionic liquids: a study of solvent-solvent and solvent-solute interactions  Full Text
AUTHORS: Reid, JESJ; Bernardes, CES ; Agapito, F; Martins, F ; Shimizu, S; da Piedade, MEM ; Walker, AJ;
PUBLISHED: 2017, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 19, ISSUE: 41
INDEXED IN: Scopus WOS CrossRef: 32
IN MY: ORCID | CIÊNCIAVITAE
47
TITLE: Structure-property relationships in protic ionic liquids: A thermochemical study  Full Text
AUTHORS: Joshua E S J Reid; Filipe Agapito; Carlos E S Bernardes ; Filomena Martins ; Adam J Walker; Seishi Shimizu; Manuel E Minas da Piedade ;
PUBLISHED: 2017, SOURCE: Physical Chemistry Chemical Physics, VOLUME: 19, ISSUE: 30
INDEXED IN: Scopus CrossRef: 16
IN MY: ORCID | CIÊNCIAVITAE
48
TITLE: Thermochemistry of 4-HOC6H4COR (R = H, CH3, C2H5, n-C3H7, n-C4H9, n-C5H11, and n-C6H13) compounds  Full Text
AUTHORS: Lopes, CSD; Agapito, F; Bernardes, CES ; da Piedade, MEM ;
PUBLISHED: 2017, SOURCE: JOURNAL OF CHEMICAL THERMODYNAMICS, VOLUME: 104
INDEXED IN: Scopus WOS CrossRef: 9
IN MY: ORCID | CIÊNCIAVITAE
49
TITLE: Additive polarizabilities in ionic liquids  Full Text
AUTHORS: Carlos E S Bernardes ; Karina Shimizu ; Jose Nuno C Canongia Lopes ; Philipp Marquetand; Esther Heid; Othmar Steinhauser; Christian Schroeder;
PUBLISHED: 2016, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 18, ISSUE: 3
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID | CIÊNCIAVITAE
50
Page 5 of 11. Total results: 101.

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