50 lines
1.3 KiB
Plaintext
50 lines
1.3 KiB
Plaintext
package "qpms-translations-ewald32"
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version "dev"
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purpose "Computes Ewald-summed VSWF translation matrix elements in arbitrary 2D-periodic infinite lattices."
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#versiontext ""
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#args "<command line options>"
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args "--file-name=transop_ewald_cmdline"
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# Options
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option "output" o "Output file"
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details="Path to the output file. If not specified, print to the standard output."
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string
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default=""
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optional
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option "normalisation" n "VSWF normalisation convention"
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values="Power","None","SH" enum
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default="Power"
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option "csphase" c "Whether the Condon-Shortley phase is included in VSWF definition (-1) or not (+1)"
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int
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values="+1","-1"
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default="-1"
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option "Ewald-parameter" e "The value of Ewald parameter η"
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double
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optional
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defmode "k_omega_points" modedesc="Specifying each (ω, k) pair separately."
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defmode "k_omega_meshgrid" modedesc="Specifying lists of ω and k, from which all possible pairs are generated."
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#option <long> <short> "<desc>"
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# {details="<detailed description>"}
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# {argtype} {typestr="<type descr>"}
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# {values="<value1>","<value2>",...}
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# {default="<default value>"}
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# {dependon="<other option>"}
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# {required} {argoptional} {multiple}
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# {hidden}
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#option <long> <short> "<desc>" flag <on/off>
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#section "section name" {sectiondesc="optional section description"}
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#text "a textual sentence"
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