c5e8568b0b27e08f530225308f606d94 impnonspi_a2018v1n1.pdf 1633d3427713c479a831bb50de0b19a6ca2de530 impnonspi_a2018v1n1.pdf e014afa11ee34d976ccd93294c4d9223d2402915ab14b2f31ff8b42469e8177f impnonspi_a2018v1n1.pdf Title: Implementation of non-collinear spin-constrained DFT calculations in SIESTA with a fully relativistic Hamiltonian Subject: Journal of Physics: Materials, 1(2018) 015010. doi:10.1088/2515-7639/aae7db Keywords: constrained DFT,magnetic exchange interactions,magnetic materials,ab initio Author: R Cuadrado Creator: IOPP Producer: iText® 5.5.10 ©2000-2015 iText Group NV (AGPL-version) CreationDate: Tue Oct 30 17:17:10 2018 CET ModDate: Mon Feb 3 17:24:05 2020 CET Tagged: no UserProperties: no Suspects: no Form: AcroForm JavaScript: no Pages: 11 Encrypted: no Page size: 595 x 842 pts (A4) Page rot: 0 File size: 629079 bytes Optimized: yes PDF version: 1.7 name type encoding emb sub uni object ID ------------------------------------ ----------------- ---------------- --- --- --- --------- Helvetica-Bold Type 1 WinAnsi no no no 522 0 DKMPMC+ArialUnicodeMS CID TrueType Identity-H yes yes yes 525 0 Helvetica Type 1 WinAnsi no no no 526 0 Helvetica-Oblique Type 1 WinAnsi no no no 527 0 NKDJNK+AdvOT255b5711.I Type 1C WinAnsi yes yes no 346 0 NKDLBL+AdvOT77db9845+fb Type 1C Custom yes yes yes 335 0 NKDLBM+AdvTT8f3612e7+f0 Type 1C Custom yes yes yes 343 0 NKDLBN+AdvTTab7e17fd Type 1C WinAnsi yes yes no 347 0 NKDLDP+Minion-Italic Type 1C WinAnsi yes yes no 345 0 NKDLFP+AdvOT8608a8d1 Type 1C WinAnsi yes yes no 349 0 NKDLHA+AdvTTec1d2308.I+03 Type 1C Custom yes yes yes 348 0 NKDJNL+AdvOT3bbb1fa6.B Type 1C WinAnsi yes yes no 342 0 NKDJNM+AdvOTb0c9bf5d Type 1C WinAnsi yes yes no 355 0 NKDJON+AdvOT77db9845 Type 1C WinAnsi yes yes no 357 0 NKDJOO+AdvTT25d87263 Type 1C WinAnsi yes yes no 359 0 NKDKGM+AdvOTb49d9406 Type 1C WinAnsi yes yes no 326 0 NKDKGN+AdvOTf5828f90 Type 1C WinAnsi yes yes no 334 0 NKDKHN+AdvOT5e4d79fc Type 1C WinAnsi yes yes no 327 0 NKDLAL+AdvOT77db9845+20 Type 1C WinAnsi yes yes no 332 0 NKDLCO+EuclidMathOne CID TrueType Identity-H yes yes yes 330 0 NKDLOO+Minion-Regular Type 1C WinAnsi yes yes no 375 0 NKDMBP+STIXGeneral-Regular Type 1C Custom yes yes yes 370 0 NKDMDA+Minion-Bold Type 1C WinAnsi yes yes no 366 0 NKDNEM+AdvTTab7e17fd+22 Type 1C Custom yes yes yes 369 0 NKDNFN+STIXSizeOneSym-Regular Type 1C Custom yes yes yes 377 0 NKDLPO+EuclidSymbol-Italic CID TrueType Identity-H yes yes yes 371 0 NKDLPP+EuclidSymbol CID TrueType Identity-H yes yes yes 365 0 NKDMJA+Euclid TrueType WinAnsi yes yes no 380 0 NKDOOG+AdvTTcad11138 Type 1C WinAnsi yes yes no 382 0 NKDNPK+EuclidSymbol-BoldItalic CID TrueType Identity-H yes yes yes 385 0 NKEAOK+AdvTTec1d2308.I Type 1C WinAnsi yes yes no 386 0 NKEBGI+AdvOT3bbb1fa6.B+fb Type 1C Custom yes yes yes 391 0 NKECMB+AdvTTab7e17fd+03 Type 1C Custom yes yes yes 394 0 NKECOB+AdvTT691e30a0 Type 1C WinAnsi yes yes no 395 0 NKEFMC+EuclidFraktur TrueType WinAnsi yes yes no 398 0 NKEHFJ+AdvOT8608a8d1+22 Type 1C Custom yes yes yes 399 0 NKEIMB+AdvOT255b5711.I+fb Type 1C Custom yes yes yes 400 0 Jhove (Rel. 1.22.1, 2019-04-17) Date: 2020-02-04 05:52:13 CET RepresentationInformation: impnonspi_a2018v1n1.pdf ReportingModule: PDF-hul, Rel. 1.12.1 (2019-04-17) LastModified: 2020-02-03 17:24:45 CET Size: 629079 Format: PDF Version: 1.7 Status: Well-Formed, but not valid SignatureMatches: PDF-hul ID: PDF-HUL-122 ErrorMessage: edu.harvard.hul.ois.jhove.module.pdf.PdfInvalidException: Invalid indirect destination - 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Introduction Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@42f30e0a Item: Title: 2. General formalism of fully relativistic constrained DFT Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@24273305 Children: Item: Title: 2.1. Noncollinear-spin DFT Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@5b1d2887 Item: Title: 2.2. Noncollinear constrained spin-DFT Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@46f5f779 Item: Title: 3. Implementation Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@1c2c22f3 Item: Title: 4. Noncollinear magnetic systems Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@18e8568 Children: Item: Title: 4.1. Linear Fe3 cluster Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@33e5ccce Item: Title: 4.2. Vanadium oxyfluoride kagome slab Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@5a42bbf4 Item: Title: 5. Application to magnetic exchange coupling Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@270421f5 Children: Item: Title: 5.1. Infinite linear Fe chain Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@52d455b8 Item: Title: 6. Conclusions Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@4f4a7090 Item: Title: Acknowledgments Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@18ef96 Item: Title: References Destination: edu.harvard.hul.ois.jhove.module.pdf.PdfSimpleObject@6956de9 Filters: FilterPipeline: FlateDecode FilterPipeline: DCTDecode Images: Image: NisoImageMetadata: FormatName: image/jpg CompressionScheme: JPEG ImageWidth: 155 ImageHeight: 57 ColorSpace: CMYK BitsPerSample: 8 BitsPerSampleUnit: integer Image: NisoImageMetadata: FormatName: image/png ImageWidth: 26 ImageHeight: 33 BitsPerSample: 8 BitsPerSampleUnit: integer Filter: FlateDecode Image: NisoImageMetadata: FormatName: image/jpg CompressionScheme: JPEG ImageWidth: 197 ImageHeight: 351 ColorSpace: RGB BitsPerSample: 8 BitsPerSampleUnit: integer Image: NisoImageMetadata: FormatName: image/png ImageWidth: 34 ImageHeight: 26 BitsPerSample: 8 BitsPerSampleUnit: integer Filter: FlateDecode Image: NisoImageMetadata: 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Pruneda A García P Ordejón 10.1088/2515-7639/aae7db http://dx.doi.org/10.1088/2515-7639/aae7db journal Journal of Physics: Materials © 2018 The Author(s). 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