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@ -139,7 +139,7 @@ commands)
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</P>
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</P>
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<UL><LI> pairwise potentials: Lennard-Jones, Buckingham, Morse, Born-Mayer-Huggins, Yukawa, soft, class 2 (COMPASS), hydrogen bond, tabulated
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<UL><LI> pairwise potentials: Lennard-Jones, Buckingham, Morse, Born-Mayer-Huggins, Yukawa, soft, class 2 (COMPASS), hydrogen bond, tabulated
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<LI> charged pairwise potentials: Coulombic, point-dipole
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<LI> charged pairwise potentials: Coulombic, point-dipole
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<LI> manybody potentials: EAM, Finnis/Sinclair EAM, modified EAM (MEAM), embedded ion method (EIM), Stillinger-Weber, Tersoff, AI-REBO, ReaxFF, COMB
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<LI> manybody potentials: EAM, Finnis/Sinclair EAM, modified EAM (MEAM), embedded ion method (EIM), Stillinger-Weber, Tersoff, REBO, AIREBO, ReaxFF, COMB
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<LI> electron force field (eFF)
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<LI> electron force field (eFF)
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<LI> coarse-grained potentials: DPD, GayBerne, REsquared, colloidal, DLVO
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<LI> coarse-grained potentials: DPD, GayBerne, REsquared, colloidal, DLVO
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<LI> mesoscopic potentials: granular, Peridynamics
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<LI> mesoscopic potentials: granular, Peridynamics
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@ -559,7 +559,7 @@ the list.
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<TR><TD >pair lubricate </TD><TD > Randy Schunk (Sandia)</TD></TR>
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<TR><TD >pair lubricate </TD><TD > Randy Schunk (Sandia)</TD></TR>
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<TR><TD >compute ackland/atom </TD><TD > Gerolf Zeigenhain</TD></TR>
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<TR><TD >compute ackland/atom </TD><TD > Gerolf Zeigenhain</TD></TR>
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<TR><TD >kspace_style ewald/n, pair_style lj/coul, pair_style buck/coul </TD><TD > Pieter in 't Veld (Sandia)</TD></TR>
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<TR><TD >kspace_style ewald/n, pair_style lj/coul, pair_style buck/coul </TD><TD > Pieter in 't Veld (Sandia)</TD></TR>
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<TR><TD >AI-REBO bond-order potential </TD><TD > Ase Henry (MIT)</TD></TR>
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<TR><TD >AIREBO bond-order potential </TD><TD > Ase Henry (MIT)</TD></TR>
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<TR><TD >making LAMMPS a true "object" that can be instantiated multiple times, e.g. as a library </TD><TD > Ben FrantzDale (RPI)</TD></TR>
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<TR><TD >making LAMMPS a true "object" that can be instantiated multiple times, e.g. as a library </TD><TD > Ben FrantzDale (RPI)</TD></TR>
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<TR><TD >pymol_asphere viz tool </TD><TD > Mike Brown (Sandia)</TD></TR>
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<TR><TD >pymol_asphere viz tool </TD><TD > Mike Brown (Sandia)</TD></TR>
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<TR><TD >NEMD SLLOD integration </TD><TD > Pieter in 't Veld (Sandia)</TD></TR>
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<TR><TD >NEMD SLLOD integration </TD><TD > Pieter in 't Veld (Sandia)</TD></TR>
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@ -136,7 +136,7 @@ commands)
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Yukawa, soft, class 2 (COMPASS), hydrogen bond, tabulated
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Yukawa, soft, class 2 (COMPASS), hydrogen bond, tabulated
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charged pairwise potentials: Coulombic, point-dipole
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charged pairwise potentials: Coulombic, point-dipole
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manybody potentials: EAM, Finnis/Sinclair EAM, modified EAM (MEAM), \
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manybody potentials: EAM, Finnis/Sinclair EAM, modified EAM (MEAM), \
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embedded ion method (EIM), Stillinger-Weber, Tersoff, AI-REBO, ReaxFF, COMB
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embedded ion method (EIM), Stillinger-Weber, Tersoff, REBO, AIREBO, ReaxFF, COMB
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electron force field (eFF)
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electron force field (eFF)
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coarse-grained potentials: DPD, GayBerne, REsquared, colloidal, DLVO
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coarse-grained potentials: DPD, GayBerne, REsquared, colloidal, DLVO
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mesoscopic potentials: granular, Peridynamics
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mesoscopic potentials: granular, Peridynamics
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@ -545,7 +545,7 @@ pair lubricate : Randy Schunk (Sandia)
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compute ackland/atom : Gerolf Zeigenhain
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compute ackland/atom : Gerolf Zeigenhain
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kspace_style ewald/n, pair_style lj/coul, pair_style buck/coul : \
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kspace_style ewald/n, pair_style lj/coul, pair_style buck/coul : \
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Pieter in 't Veld (Sandia)
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Pieter in 't Veld (Sandia)
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AI-REBO bond-order potential : Ase Henry (MIT)
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AIREBO bond-order potential : Ase Henry (MIT)
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making LAMMPS a true "object" that can be instantiated multiple times, \
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making LAMMPS a true "object" that can be instantiated multiple times, \
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e.g. as a library : Ben FrantzDale (RPI)
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e.g. as a library : Ben FrantzDale (RPI)
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pymol_asphere viz tool : Mike Brown (Sandia)
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pymol_asphere viz tool : Mike Brown (Sandia)
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@ -116,11 +116,7 @@ other potentials.
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<P>The parameters/coefficients for the AIREBO potentials are listed in
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<P>The parameters/coefficients for the AIREBO potentials are listed in
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the CH.airebo file to agree with the original <A HREF = "#Stuart">(Stuart)</A>
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the CH.airebo file to agree with the original <A HREF = "#Stuart">(Stuart)</A>
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paper. Thus the parameters are specific to this potential and the way
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paper. Thus the parameters are specific to this potential and the way
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it was fit, so modifying the file should be done cautiously. Also
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it was fit, so modifying the file should be done cautiously.
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note that the E_LJ and E_TORSION terms in AIREBO are intended to be
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used with the E_REBO term and not as stand-alone potentials. Thus we
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don't suggest you use pair_style airebo with the E_REBO term turned
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off.
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</P>
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</P>
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<HR>
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<HR>
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@ -112,11 +112,7 @@ other potentials.
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The parameters/coefficients for the AIREBO potentials are listed in
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The parameters/coefficients for the AIREBO potentials are listed in
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the CH.airebo file to agree with the original "(Stuart)"_#Stuart
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the CH.airebo file to agree with the original "(Stuart)"_#Stuart
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paper. Thus the parameters are specific to this potential and the way
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paper. Thus the parameters are specific to this potential and the way
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it was fit, so modifying the file should be done cautiously. Also
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it was fit, so modifying the file should be done cautiously.
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note that the E_LJ and E_TORSION terms in AIREBO are intended to be
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used with the E_REBO term and not as stand-alone potentials. Thus we
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don't suggest you use pair_style airebo with the E_REBO term turned
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off.
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:line
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:line
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