| Nome |
# |
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Carbon-atom wires: 1-D systems with tunable properties, file e0c31c09-24c1-4599-e053-1705fe0aef77
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795
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Unpolarized and Polarized Raman Spectroscopy of Nylon-6 Polymorphs: A Quantum Chemical Approach, file e0c31c0e-bbbf-4599-e053-1705fe0aef77
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515
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Carbyne: from the elusive allotrope to stable carbon atom wires, file e0c31c0c-049c-4599-e053-1705fe0aef77
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274
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Raman spectroscopy as a tool to investigate the structure and electronic properties of carbon-atom wires, file e0c31c07-be70-4599-e053-1705fe0aef77
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243
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Raman and IR spectra of graphdiyne nanoribbons, file e0c31c0f-7c3e-4599-e053-1705fe0aef77
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207
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Intermolecular modulation of IR intensities in the solid state. the role of weak interactions in polyethylene crystal: A computational DFT study, file e0c31c09-f316-4599-e053-1705fe0aef77
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194
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A halogen bond-donor amino acid for organocatalysis in water, file e0c31c11-175e-4599-e053-1705fe0aef77
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193
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Structure modulated charge transfer in carbon atomic wires, file e0c31c0d-0af1-4599-e053-1705fe0aef77
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160
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π-Conjugation and Endgroup Effects in Long Cumulenes: Raman Spectroscopy and DFT Calculations, file e0c31c0d-c31d-4599-e053-1705fe0aef77
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148
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Semiconductor-to-Metal Transition in Carbon-Atom Wires Driven by sp2 Conjugated End Groups, file e0c31c0b-8232-4599-e053-1705fe0aef77
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143
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Copper-surface-mediated synthesis of acetylenic carbon-rich nanofibers for active metal-free photocathodes, file e0c31c0b-d1a1-4599-e053-1705fe0aef77
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141
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A Field-Effect Transistor Based on Cumulenic sp-Carbon Atomic Wires, file e0c31c0f-990a-4599-e053-1705fe0aef77
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136
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Fingerprints of sp1 Hybridized C in the near-edge X-ray absorption spectra of surface-grown materials, file e0c31c0c-fc5d-4599-e053-1705fe0aef77
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128
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Domino reaction for the sustainable functionalization of few-layer graphene, file e0c31c0c-e96c-4599-e053-1705fe0aef77
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124
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One-pot synthesis and characterization of polyynes end-capped by biphenyl groups (alpha,omega-biphenylpolyynes), file e0c31c0b-822f-4599-e053-1705fe0aef77
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119
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In situ synthesis of polyynes in a polymer matrix via pulsed laser ablation in a liquid, file e0c31c10-78e9-4599-e053-1705fe0aef77
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113
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Scanning tunneling microscopy and Raman spectroscopy of polymeric sp-sp2 carbon atomic wires synthesized on the Au(111) surface, file e0c31c0e-c127-4599-e053-1705fe0aef77
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93
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Size-selected polyynes synthesised by submerged arc discharge in water, file e0c31c0f-3dd8-4599-e053-1705fe0aef77
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85
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A revisitation of the polymorphism of poly(butylene-2,6-naphthalate) from periodic first-principles calculations, file e0c31c0d-2e17-4599-e053-1705fe0aef77
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82
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Structural, Electronic, and Vibrational Properties of a Two-Dimensional Graphdiyne-like Carbon Nanonetwork Synthesized on Au(111): Implications for the Engineering of sp-sp2 Carbon Nanostructures, file e0c31c10-6474-4599-e053-1705fe0aef77
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75
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Vibrational and nonlinear optical properties of amine-capped push-pull polyynes by infrared and Raman spectroscopy, file e0c31c12-14e2-4599-e053-1705fe0aef77
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62
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Thiophene-Based Conjugated Acetylenic Polymers with Dual Active Sites for Efficient Co-Catalyst-Free Photoelectrochemical Water Reduction in Alkaline Medium, file e0c31c11-78f6-4599-e053-1705fe0aef77
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58
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Polymorphism of Poly(butylene terephthalate) Investigated by Means of Periodic Density Functional Theory Calculations, file e0c31c0d-4541-4599-e053-1705fe0aef77
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54
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Crystal Structure and Vibrational Spectra of Poly(trimethylene terephthalate) from Periodic Density Functional Theory Calculations, file e0c31c0d-a2bd-4599-e053-1705fe0aef77
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49
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Domino reaction for the controlled functionalization of sp2 carbon allotropes, file e0c31c0b-9951-4599-e053-1705fe0aef77
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46
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Polymorphism of even nylons revisited through periodic quantum chemical calculations, file e0c31c0e-b6ea-4599-e053-1705fe0aef77
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46
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Bottom-Up Synthesis of Heteroatom-Doped Chiral Graphene Nanoribbons, file e0c31c0c-691d-4599-e053-1705fe0aef77
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44
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Corrigendum to “One-pot synthesis and characterization of polyynes end-capped by biphenyl groups (α,ω-biphenylpolyynes)” (Carbon (2018) 126 (232–240), (S0008622317309818), (10.1016/j.carbon.2017.09.098))>, file e0c31c11-a97d-4599-e053-1705fe0aef77
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44
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Topology-dependent conjugation effects in graphdiyne molecular fragments, file e0c31c11-80ba-4599-e053-1705fe0aef77
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37
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Raman spectroscopy as a tool to investigate the structure and electronic properties of carbon-atom wires, file e0c31c07-becf-4599-e053-1705fe0aef77
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33
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Solvent-dependent termination, size and stability in polyynes synthesis by laser ablation in liquids, file e0c31c12-cb45-4599-e053-1705fe0aef77
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12
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Graphdiynes interacting with metal surfaces: First-principles electronic and vibrational properties, file e0c31c11-db30-4599-e053-1705fe0aef77
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6
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Color Polymorphs of ROY-ol, file bc8019af-e0e1-47c5-80dd-d576bf23606e
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3
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Polaron Confinement in n-Doped P(NDI2OD-T2) Unveiled by Vibrational Spectroscopy, file e0c31c0f-2c83-4599-e053-1705fe0aef77
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3
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Polymorphism of Poly(butylene terephthalate) Investigated by Means of Periodic Density Functional Theory Calculations, file e0c31c08-1790-4599-e053-1705fe0aef77
|
2
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Crystal Structure and Vibrational Spectra of Poly(trimethylene terephthalate) from Periodic Density Functional Theory Calculations, file e0c31c08-1791-4599-e053-1705fe0aef77
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2
|
|
π-Conjugation and Endgroup Effects in Long Cumulenes: Raman Spectroscopy and DFT Calculations, file e0c31c08-1eab-4599-e053-1705fe0aef77
|
2
|
|
A revisitation of the polymorphism of poly(butylene-2,6-naphthalate) from periodic first-principles calculations, file e0c31c08-2330-4599-e053-1705fe0aef77
|
2
|
|
Linear Carbon: From 1D Carbyne to 2D Hybrid sp-sp2 Nanostructures Beyond Graphene, file e0c31c0e-175e-4599-e053-1705fe0aef77
|
2
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Polaron Confinement in n-Doped P(NDI2OD-T2) Unveiled by Vibrational Spectroscopy, file e0c31c0f-068c-4599-e053-1705fe0aef77
|
2
|
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Solvent-dependent termination, size and stability in polyynes synthesis by laser ablation in liquids, file e0c31c10-1713-4599-e053-1705fe0aef77
|
2
|
|
Unpolarized and Polarized Raman Spectroscopy of Nylon-6 Polymorphs: A Quantum Chemical Approach, file e0c31c07-be73-4599-e053-1705fe0aef77
|
1
|
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Chemical modification of Hyflon® AD copolymer end groups by means of physical and chemical treatments. A joint spectroscopic and quantum chemical investigation, file e0c31c08-2583-4599-e053-1705fe0aef77
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1
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|
Polymorphism of even nylons revisited through periodic quantum chemical calculations, file e0c31c08-8125-4599-e053-1705fe0aef77
|
1
|
|
Joint Experimental and Computational Investigation of the Structural and Spectroscopic Properties of Poly(vinylidene fluoride) Polymorphs, file e0c31c08-8127-4599-e053-1705fe0aef77
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1
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|
Static vs dynamic DFT prediction of IR spectra of flexible molecules in the condensed phase: The (ClCF2CF(CF3)OCF2CH3) liquid as a test case, file e0c31c0b-562c-4599-e053-1705fe0aef77
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1
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Bottom-Up Synthesis of Heteroatom-Doped Chiral Graphene Nanoribbons, file e0c31c0c-4a61-4599-e053-1705fe0aef77
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1
|
|
The correlation between experimental polarized Raman spectra and their density functional theory prediction in the LCAO framework: The R3c LiNbO3 crystal as a test case, file e0c31c10-efd3-4599-e053-1705fe0aef77
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1
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|
Polymorphism in 1-methylhydantoin: Investigation by periodic DFT calculations and characterization of the third polymorph, file e0c31c11-3c03-4599-e053-1705fe0aef77
|
1
|
|
Solvent-mediated engineering of copper-metalated acetylenic polymer scaffolds with enhanced photoelectrochemical performance, file e0c31c11-d225-4599-e053-1705fe0aef77
|
1
|
|
Graphdiynes interacting with metal surfaces: First-principles electronic and vibrational properties, file e0c31c12-0d0a-4599-e053-1705fe0aef77
|
1
|
|
2,4,6-Trinitro- N-(m-tolyl)aniline: A New Polymorphic Material Exhibiting Different Colors, file e0c31c12-3fcd-4599-e053-1705fe0aef77
|
1
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| Totale |
4.490 |