Michael Springborg

Utrecht University

H指数:37

被引数:5,226

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Reaction mechanism of palladium-catalyzed intramolecular cyclization/hydroamination of 1-(2-aminophenyl)-3-phenylprop-2yn-1-one, CN bond formation processes studied with DFT calculations

钯催化的1-(2-氨基苯基)-3-苯基丙-2-炔-1-酮分子内环化/氢氨化反应机理及CN键形成过程（通过DFT计算研究）

Computational and Theoretical Chemistry

IF2.8

2025-07-080

PRE

Properties of Naked Silver Clusters with Up to 100 Atoms as Found with Embedded-Atom and Density-Functional Calculations

通过嵌入原子和密度泛函计算发现的具有多达100个原子的裸银团簇的性质

MOLECULES

IF4.6

2023-04-064

OAAI

Theoretical Study on Non-Linear Optics Properties of Polycyclic Aromatic Hydrocarbons and the Effect of Their Intercalation with Carbon Nanotubes

MOLECULES

IF4.6

2022-12-234

OAAI

Nonlinear optical properties DFT calculations of polyacethylene and copolymers models substituted with aldimines chromophores as side chains

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2022-08-082

PRE

Kinetics and Thermodynamics of CO Oxidation by (TiO2)6

(TiO2)6氧化CO的动力学和热力学

MOLECULES

IF4.6

2021-10-240

OAAI

Silver hollandite (AgxMn8O16, x ≤ 2): A highly anisotropic half-metal for spintronics

PHYSICAL REVIEW MATERIALS

IF3.4

2021-09-011

PRE

Surfaces, Shapes, and Bulk Properties of Crystals

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2018-05-1610

PREAI

From properties to materials: An efficient and simple approach

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2017-12-1816

PREAI

Electronic orbital response of regular extended and infinite periodic systems to magnetic fields. I. Theoretical foundations for static case

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2017-09-082

PREAI

Computational study of the reactivity of cytosine derivatives

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2017-03-205

PREAI

Atomistic simulation of nanoindentation using the DFTB method

COMPUTATIONAL MATERIALS SCIENCE

IF3.3

2016-06-012

PREAI

Hydrogenation properties of LixSr1-xAlSi studied by quantum-chemical methods (0 ≤ x ≤ 1) and in-situ neutron powder diffraction (x=1)

JOURNAL OF SOLID STATE CHEMISTRY

IF3.5

2015-01-012

PREAI

Electronic responses of long chains to electrostatic fields: Hartree-Fock vs. density-functional theory: A model study

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2014-02-079

PREAI

Eu(II) luminescence in the perovskite host lattices KMgH3, NaMgH3 and mixed crystals LiBaxSr1-xH3

JOURNAL OF MATERIALS CHEMISTRY C

IF5.1

2014-01-0126

OAAI

Electronic Structure of Ternary Rhodium Hydrides with Lithium and Magnesium

INORGANIC CHEMISTRY

IF4.7

2013-12-274

PREAI

On Aliovalent Substitution on the Li Site in LiMPO4: an X-ray Diffraction Study of the Systems LiMPO4-M1.5PO4 (=LixM1.5-x/2PO4; M = Ni, Co, Fe, Mn)

ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE

IF1.1

2013-10-157

PREAI

Synthesis and Characterization of Vanadium-Doped LiMnPO4-Compounds: LiMn(PO4)x(VO4)1-x (0.8 ≤ x ≤ 1.0)

钒掺杂LiMnPO4-Compounds: LiMn(PO4)x(VO4)1-x (0.8 ≤ x ≤ 1.0) 的合成与表征

CHEMISTRY OF MATERIALS

IF7

2012-12-0427

PREAI

Building band structures for long finite chains in presence of an electric field

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2012-10-121

OAAI

Neutron and X-ray diffraction studies on the high temperature phase of Mn3(VO4)2, the new isostructural compound NaMn4(VO4)3 and their mixed crystals NaxMn4.5-x/2(VO4)3 (0 ≤ x ≤ 1)

Mn3(VO4)2，新的同构化合物NaMn4(VO4)3及其混合晶体NaxMn4.5-X/2(VO4)3 (0 ≤ x ≤ 1) 的高温相的中子和x射线衍射研究

JOURNAL OF SOLID STATE CHEMISTRY

IF3.5

2012-10-018

PREAI

Ab initio study of metastable layered perovskites R2Ti2O7 (R = Sm and Gd)

PHYSICAL REVIEW B

IF3.7

2012-09-2711

PREAI

Michael Springborg

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