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Lmp.numpy.extract_fix() returns a sugle float when used with LMP_STYLE_GLOBAL and LMP_TYPE_ARRAY
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6
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95
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March 20, 2024
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Question on defining a bond coefficient as a variable, and printing out the data files related to each bond coefficient
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5
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70
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March 20, 2024
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How can I convert Vasp OUTCAR file to extxyz with charge & virial for all frames?
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1
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110
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March 20, 2024
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CMAP atoms missing on proc error
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3
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63
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March 18, 2024
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I have a question about the crystallographic information of Fe2B
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1
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76
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March 14, 2024
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Step function not recognised for lepton bond
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2
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72
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March 14, 2024
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LAMMPS compile | OLCF-Frontier
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2
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77
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March 13, 2024
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Questions about the data
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0
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70
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March 13, 2024
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Melting Point Simulation Question
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2
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103
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March 11, 2024
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EAM\Alloy
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1
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88
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March 10, 2024
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How do I create bonds in a FCC lattice
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2
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104
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March 10, 2024
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Gmake error during cmake build with intel compiler
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6
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101
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March 7, 2024
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Incorrect argument when using quip in lammps
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4
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84
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March 5, 2024
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Failed data upload: parsers/cp2k
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6
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74
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March 4, 2024
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Invalid dump frequency Error when exceeding 32-bit integer timestep
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2
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91
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March 4, 2024
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Error when trying to compile with new potentials
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8
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109
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March 3, 2024
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Error creating own project on the website
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3
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82
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March 2, 2024
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“Bond atom missing in image check” error
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3
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128
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February 29, 2024
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Fail accessing data from DOI: 10.17188/1476059
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2
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66
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March 1, 2024
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EspressoProfile not working
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1
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97
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March 1, 2024
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High fluctuations in the thermodynamic properties of mixtures
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2
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275
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September 13, 2023
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ERROR: Unrecognized compute style 'born/matrix' (src/modify.cpp:1265) Last command: compute born all born/matrix numdiff 1.0e-6 VIR
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3
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86
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February 24, 2024
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Two Issues with importing `ElementProperty`
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2
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274
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February 23, 2024
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Mp-22584: LiMn2O4 (LMO) structural info mismatch
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0
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142
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November 16, 2023
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Error in Fix Halt
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2
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91
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February 22, 2024
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Issue with API Access for Element Database Retrieval
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1
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67
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February 20, 2024
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Error from molecule and read_data commands
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1
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73
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February 18, 2024
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Per-atom ERROR in newer version of compute reduce
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1
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87
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February 17, 2024
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How to use gaff(amber based forcefield) & OPLSAA forcefield together?
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2
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138
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February 16, 2024
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Mpr.get_phonon_dos_by_material_id stops working
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1
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85
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February 15, 2024
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