forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@7743 f3b2605a-c512-4ea7-a41b-209d697bcdaa
This commit is contained in:
parent
d850025578
commit
4a72d0fe71
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@ -55,8 +55,8 @@ E: Cannot use newton pair with buck/coul/cut/gpu pair style
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UNDOCUMENTED
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E: Pair style buck/coul/cut/gpu requires atom attribute q
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U: Pair style buck/coul/cut/gpu requires atom attribute q
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The atom style defined does not have this attribute.
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*/
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*/
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@ -51,12 +51,16 @@ E: Out of memory on GPGPU
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UNDOCUMENTED
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E: Cannot use newton pair with buck/coul/long/gpu pair style
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UNDOCUMENTED
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E: Pair style buck/coul/long/gpu requires atom attribute q
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The atom style defined does not have this attribute.
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*/
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E: Cannot use newton pair with buck/coul/long/gpu pair style
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UNDOCUMENTED
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E: Pair style is incompatible with KSpace style
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UNDOCUMENTED
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*/
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@ -55,4 +55,4 @@ E: Cannot use newton pair with buck/gpu pair style
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UNDOCUMENTED
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*/
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*/
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@ -39,3 +39,23 @@ public:
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Incorrect args for pair coefficients
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UNDOCUMENTED
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E: No matching element in EAM potential file
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UNDOCUMENTED
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E: Cannot open EAM potential file %s
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UNDOCUMENTED
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E: Incorrect element names in EAM potential file
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UNDOCUMENTED
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*/
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@ -39,3 +39,23 @@ public:
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Incorrect args for pair coefficients
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UNDOCUMENTED
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E: No matching element in EAM potential file
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UNDOCUMENTED
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E: Cannot open EAM potential file %s
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UNDOCUMENTED
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E: Incorrect element names in EAM potential file
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UNDOCUMENTED
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*/
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@ -66,4 +66,4 @@ E: Not allocate memory eam/gpu pair style
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UNDOCUMENTED
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*/
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*/
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@ -47,3 +47,22 @@ class PairLJSDKCoulLongGPU : public PairLJSDKCoulLong {
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Out of memory on GPGPU
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UNDOCUMENTED
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E: Pair style lj/sdk/coul/long/gpu requires atom attribute q
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UNDOCUMENTED
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E: Cannot use newton pair with lj/sdk/coul/long/gpu pair style
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UNDOCUMENTED
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E: Pair style is incompatible with KSpace style
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UNDOCUMENTED
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*/
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@ -46,3 +46,15 @@ class PairLJSDKGPU : public PairLJSDK {
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}
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Out of memory on GPGPU
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UNDOCUMENTED
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E: Cannot use newton pair with lj/sdk/gpu pair style
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UNDOCUMENTED
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*/
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@ -55,8 +55,12 @@ E: Cannot use newton pair with table/gpu pair style
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UNDOCUMENTED
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E: Pair distance < table inner cutoff
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UNDOCUMENTED
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E: Pair distance > table outer cutoff
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Two atoms are further apart than the pairwise table allows.
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*/
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*/
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@ -55,4 +55,4 @@ E: Cannot use newton pair with yukawa/gpu pair style
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UNDOCUMENTED
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*/
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*/
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@ -112,3 +112,39 @@ class PairKIM : public Pair {
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Illegal ... command
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UNDOCUMENTED
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E: Incorrect args for pair coefficients
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UNDOCUMENTED
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E: Pair style pair_KIM requires newton pair Off
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UNDOCUMENTED
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E: All pair coeffs are not set
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UNDOCUMENTED
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E: KIM neighbor iterator exceeded range
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UNDOCUMENTED
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E: KIM_DIR environement variable is unset
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UNDOCUMENTED
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E: PWD environement variable is unset
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UNDOCUMENTED
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E: KIM initialization failed
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UNDOCUMENTED
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*/
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@ -69,3 +69,35 @@ class Balance : protected Pointers {
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#endif
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#endif
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/* ERROR/WARNING messages:
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E: Balance command before simulation box is defined
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UNDOCUMENTED
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E: Illegal ... command
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UNDOCUMENTED
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E: Cannot balance in z dimension for 2d simulation
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UNDOCUMENTED
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E: Balance dynamic string is invalid
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UNDOCUMENTED
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E: Balance dynamic string is invalid for 2d simulation
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UNDOCUMENTED
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E: Lost atoms via balance: original %ld current %ld
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UNDOCUMENTED
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E: Cannot open balance output file
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UNDOCUMENTED
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*/
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@ -59,9 +59,9 @@ class ChangeBox : protected Pointers {
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/* ERROR/WARNING messages:
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E: Displace_box command before simulation box is defined
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E: Change_box command before simulation box is defined
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Self-explanatory.
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UNDOCUMENTED
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E: Illegal ... command
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@ -69,40 +69,92 @@ Self-explanatory. Check the input script syntax and compare to the
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documentation for the command. You can use -echo screen as a
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command-line option when running LAMMPS to see the offending line.
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E: Cannot displace_box after reading restart file with per-atom info
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E: Cannot change_box after reading restart file with per-atom info
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UNDOCUMENTED
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E: Could not find change_box group ID
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UNDOCUMENTED
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E: Cannot change_box in z dimension for 2d simulation
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UNDOCUMENTED
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E: Change_box volume used incorrectly
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UNDOCUMENTED
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E: Cannot change_box in xz or yz for 2d simulation
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UNDOCUMENTED
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E: Use of change_box with undefined lattice
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UNDOCUMENTED
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E: Cannot change box tilt factors for orthogonal box
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UNDOCUMENTED
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E: Cannot run 2d simulation with nonperiodic Z dimension
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UNDOCUMENTED
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E: Cannot change box to orthogonal when tilt is non-zero
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UNDOCUMENTED
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E: Cannot change box ortho/triclinic with dumps defined
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UNDOCUMENTED
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E: Cannot change box ortho/triclinic with certain fixes defined
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UNDOCUMENTED
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W: Lost atoms via change_box: original %ld current %ld
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UNDOCUMENTED
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U: Displace_box command before simulation box is defined
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Self-explanatory.
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U: Cannot displace_box after reading restart file with per-atom info
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This is because the restart file info cannot be migrated with the
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atoms. You can get around this by performing a 0-timestep run which
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will assign the restart file info to actual atoms.
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E: Could not find displace_box group ID
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U: Could not find displace_box group ID
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Group ID used in the displace_box command does not exist.
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E: Displace_box tilt factors require triclinic box
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U: Displace_box tilt factors require triclinic box
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Cannot use tilt factors unless the simulation box is
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non-orthogonal.
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E: Cannot displace_box on a non-periodic boundary
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U: Cannot displace_box on a non-periodic boundary
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Self-explanatory.
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E: Use of displace_box with undefined lattice
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U: Use of displace_box with undefined lattice
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Must use lattice command with displace_box command if units option is
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set to lattice.
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E: Fix deform volume setting is invalid
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U: Fix deform volume setting is invalid
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Cannot use volume style unless other dimensions are being controlled.
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E: Induced tilt by displace_box is too large
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U: Induced tilt by displace_box is too large
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The final tilt value must be between -1/2 and 1/2 of the perpendicular
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box length.
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E: Lost atoms via displace_box: original %ld current %ld
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U: Lost atoms via displace_box: original %ld current %ld
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UNDOCUMENTED
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@ -155,6 +155,10 @@ E: Invalid cutoff in communicate command
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Specified cutoff must be >= 0.0.
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E: Specified processors != physical processors
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UNDOCUMENTED
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E: Cannot use processors part command without using partitions
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UNDOCUMENTED
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10
src/domain.h
10
src/domain.h
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@ -137,11 +137,6 @@ E: Cannot skew triclinic box in z for 2d simulation
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Self-explanatory.
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E: Triclinic box must be periodic in skewed dimensions
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This is a requirement for using a non-orthogonal box. E.g. to set a
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non-zero xy tilt, both x and y must be periodic dimensions.
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E: Triclinic box skew is too large
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The displacement in a skewed direction must be less than half the box
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@ -175,4 +170,9 @@ E: Both sides of boundary must be periodic
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Cannot specify a boundary as periodic only on the lo or hi side. Must
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be periodic on both sides.
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U: Triclinic box must be periodic in skewed dimensions
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This is a requirement for using a non-orthogonal box. E.g. to set a
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non-zero xy tilt, both x and y must be periodic dimensions.
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*/
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@ -165,26 +165,10 @@ E: Invalid dump image persp value
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UNDOCUMENTED
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E: Invalid dump image up vector
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UNDOCUMENTED
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E: Invalid dump image color range
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UNDOCUMENTED
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E: Invalid color in dump_modify command
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UNDOCUMENTED
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E: Illega dump_modify command
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UNDOCUMENTED
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E: Invalid color map in dump_modify command
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UNDOCUMENTED
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E: Dump modify bcolor not allowed with no bond types
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UNDOCUMENTED
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@ -193,4 +177,20 @@ E: Dump modify bdiam not allowed with no bond types
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UNDOCUMENTED
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U: Invalid dump image up vector
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UNDOCUMENTED
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U: Invalid dump image color range
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UNDOCUMENTED
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U: Illega dump_modify command
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UNDOCUMENTED
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U: Invalid color map in dump_modify command
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UNDOCUMENTED
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*/
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@ -86,16 +86,13 @@ E: Fix deform tilt factors require triclinic box
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Cannot deform the tilt factors of a simulation box unless it
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is a triclinic (non-orthogonal) box.
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E: Cannot use fix deform on a non-periodic boundary
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E: Cannot use fix deform on a shrink-wrapped boundary
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When specifying a change is a box dimension, the dimension must be
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periodic.
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UNDOCUMENTED
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E: Cannot use fix deform on a 2nd non-periodic boundary
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E: Cannot use fix deform tilt on a shrink-wrapped 2nd dim
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When specifying a tilt factor change, the 2nd of the two dimensions
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must be periodic. E.g. if the xy tilt is specified, then the y
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dimension must be periodic.
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UNDOCUMENTED
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E: Use of fix deform with undefined lattice
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@ -109,6 +106,14 @@ E: More than one fix deform
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Only one fix deform can be defined at a time.
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E: Variable name for fix deform does not exist
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UNDOCUMENTED
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E: Variable for fix deform is invalid style
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UNDOCUMENTED
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E: Final box dimension due to fix deform is < 0.0
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Self-explanatory.
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@ -117,7 +122,26 @@ E: Cannot use fix deform trate on a box with zero tilt
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The trate style alters the current strain.
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E: Fix deform is changing yz by too much with changing xy
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E: Fix deform cannot use yz variable with xy
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UNDOCUMENTED
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E: Fix deform is changing yz too much with xy
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UNDOCUMENTED
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U: Cannot use fix deform on a non-periodic boundary
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When specifying a change is a box dimension, the dimension must be
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periodic.
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U: Cannot use fix deform on a 2nd non-periodic boundary
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When specifying a tilt factor change, the 2nd of the two dimensions
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must be periodic. E.g. if the xy tilt is specified, then the y
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dimension must be periodic.
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U: Fix deform is changing yz by too much with changing xy
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When both yz and xy are changing, it induces changes in xz if the
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box must flip from one tilt extreme to another. Thus it is not
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|
|
12
src/image.h
12
src/image.h
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@ -151,3 +151,15 @@ class Image : protected Pointers {
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}
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|
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#endif
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/* ERROR/WARNING messages:
|
||||
|
||||
E: Invalid image up vector
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
E: Invalid image color range
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
*/
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|
|
|
@ -13,7 +13,11 @@
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|||
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||||
/* ERROR/WARNING messages:
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||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
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||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
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|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
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|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
||||
|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
||||
|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
||||
|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
||||
|
|
|
@ -13,7 +13,11 @@
|
|||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Neighbor list overflow, boost neigh_modify one or page
|
||||
E: Neighbor list overflow, boost neigh_modify one
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
U: Neighbor list overflow, boost neigh_modify one or page
|
||||
|
||||
There are too many neighbors of a single atom. Use the neigh_modify
|
||||
command to increase the neighbor page size and the max number of
|
||||
|
|
|
@ -51,3 +51,19 @@ class PairBeck : public Pair {
|
|||
|
||||
#endif
|
||||
#endif
|
||||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Illegal ... command
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
E: Incorrect args for pair coefficients
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
E: All pair coeffs are not set
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
*/
|
||||
|
|
|
@ -79,11 +79,6 @@ Self-explanatory. Check the input script syntax and compare to the
|
|||
documentation for the command. You can use -echo screen as a
|
||||
command-line option when running LAMMPS to see the offending line.
|
||||
|
||||
E: Pair style hybrid cannot use same pair style twice
|
||||
|
||||
The sub-style arguments of pair_style hybrid cannot be duplicated.
|
||||
Check the input script.
|
||||
|
||||
E: Pair style hybrid cannot have hybrid as an argument
|
||||
|
||||
Self-explanatory.
|
||||
|
@ -126,4 +121,9 @@ E: Coulomb cutoffs of pair hybrid sub-styles do not match
|
|||
If using a Kspace solver, all Coulomb cutoffs of long pair styles must
|
||||
be the same.
|
||||
|
||||
U: Pair style hybrid cannot use same pair style twice
|
||||
|
||||
The sub-style arguments of pair_style hybrid cannot be duplicated.
|
||||
Check the input script.
|
||||
|
||||
*/
|
||||
|
|
|
@ -52,3 +52,15 @@ class PairLJSmoothLinear : public Pair {
|
|||
|
||||
#endif
|
||||
#endif
|
||||
|
||||
/* ERROR/WARNING messages:
|
||||
|
||||
E: Illegal ... command
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
E: Incorrect args for pair coefficients
|
||||
|
||||
UNDOCUMENTED
|
||||
|
||||
*/
|
||||
|
|
|
@ -207,9 +207,9 @@ E: Thermo and fix not computed at compatible times
|
|||
Fixes generate values on specific timesteps. The thermo output
|
||||
does not match these timesteps.
|
||||
|
||||
E: Could not find thermo custom variable name
|
||||
E: Could not find thermo variable name
|
||||
|
||||
Self-explanatory.
|
||||
UNDOCUMENTED
|
||||
|
||||
E: Too many total atoms
|
||||
|
||||
|
@ -318,6 +318,10 @@ E: Thermo fix array is accessed out-of-range
|
|||
|
||||
Self-explanatory.
|
||||
|
||||
E: Could not find thermo custom variable name
|
||||
|
||||
Self-explanatory.
|
||||
|
||||
E: Thermo custom variable is not equal-style variable
|
||||
|
||||
Only equal-style variables can be output with thermodynamics, not
|
||||
|
|
Loading…
Reference in New Issue